Thymidylate Synthase

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  1. N,O-Didansyl-L-tyrosine cyclohexylammonium salt
    CAS: 102783-47-1 PubChem CID: 71308549 Formula: C39H46N4O7S2 Molecular Weight: 746.94
    ◐ .Made to order · 8–12 wks Item #: N334716
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    IUPAC Name
    cyclohexanamine;(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-[4-[5-(dimethylamino)naphthalen-1-yl]sulfonyloxyphenyl]propanoic acid
    SMILES
    CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC5=C4C=CC=C5N(C)C)C(=O)O.C1CCC(CC1)N
    InChIKey
    MVXVRKZUVTWXRD-JCOPYZAKSA-N
    InChI
    1S/C33H33N3O7S2.C6H13N/c1-35(2)29-13-5-11-26-24(29)9-7-15-31(26)44(39,40)34-28(33(37)38)21-22-17-19-23(20-18-22)43-45(41,42)32-16-8-10-25-27(32)12-6-1show more
    Synonyms
    cyclohexanamine;(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-[4-[5-(dimethylamino)naphthalen-1-yl]sulfo...
  2. Nolatrexed dihydrochloride(AG 337)
    CAS: 152946-68-4 EC Number: 680-267-3 PubChem CID: 135409535 Formula: C14H14Cl2N4OS Molecular Weight: 357.26
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ◐ .Made to order · 8–12 wks Item #: N338908
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    IUPAC Name
    2-amino-6-methyl-5-pyridin-4-ylsulfanyl-3H-quinazolin-4-one;dihydrochloride
    SMILES
    CC1=C(C2=C(C=C1)N=C(NC2=O)N)SC3=CC=NC=C3.Cl.Cl
    InChIKey
    PJKVJJYMWOCLIJ-UHFFFAOYSA-N
    InChI
    1S/C14H12N4OS.2ClH/c1-8-2-3-10-11(13(19)18-14(15)17-10)12(8)20-9-4-6-16-7-5-9;;/h2-7H,1H3,(H3,15,17,18,19);2*1H
    Synonyms
    4(1H)-Quinazolinone, 2-amino-6-methyl-5-(4-pyridinylthio)-, dihydrochloride | Nolatrexed dihydrochloride | 2-Amino-6-...
  3. 7H-Pyrrolo[2,3-d]pyrimidine-2,4-diol
    CAS: 39929-79-8 EC Number: 609-755-6 Formula: C6H5N3O2 Molecular Weight: 151.1
    ● In Stock — US warehouse, ships to EU* Item #: D184297
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    1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione
    SMILES
    C1=CNC2=C1C(=O)NC(=O)N2
    InChIKey
    HASUWNAFLUMMFI-UHFFFAOYSA-N
    InChI
    1S/C6H5N3O2/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H3,7,8,9,10,11)
    Synonyms
    1,7-Dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione | 1,7-dihydropyrrolo[2,3-d]pyrimidine-2,4-dione | DEAZAXANTHINE | SESO...
  4. Raltitrexed, Thymidylate synthase inhibitor
    CAS: 112887-68-0 PubChem CID: 135400182 Formula: C21H22N4O6S Molecular Weight: 458.49
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: R129835
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    IUPAC Name
    (2S)-2-[[5-[methyl-[(2-methyl-4-oxo-3H-quinazolin-6-yl)methyl]amino]thiophene-2-carbonyl]amino]pentanedioic acid
    SMILES
    CC1=NC2=C(C=C(C=C2)CN(C)C3=CC=C(S3)C(=O)NC(CCC(=O)O)C(=O)O)C(=O)N1
    InChIKey
    IVTVGDXNLFLDRM-HNNXBMFYSA-N
    InChI
    1S/C21H22N4O6S/c1-11-22-14-4-3-12(9-13(14)19(28)23-11)10-25(2)17-7-6-16(32-17)20(29)24-15(21(30)31)5-8-18(26)27/h3-4,6-7,9,15H,5,8,10H2,1-2H3,(H,24,29show more
    Synonyms
    N-[(5-{methyl[(2-methyl-4-oxo-1,4-dihydroquinazolin-6-yl)methyl]amino}thiophen-2-yl)carbonyl]-L-glutamic acid | RALTI...
  5. Trifluridine
    CAS: 70-00-8 EC Number: 200-722-8 PubChem CID: 6256 Formula: C10H11F3N2O5 Molecular Weight: 296.2
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: T129222
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    IUPAC Name
    1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)pyrimidine-2,4-dione
    SMILES
    C1C(C(OC1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O
    InChIKey
    VSQQQLOSPVPRAZ-RRKCRQDMSA-N
    InChI
    1S/C10H11F3N2O5/c11-10(12,13)4-2-15(9(19)14-8(4)18)7-1-5(17)6(3-16)20-7/h2,5-7,16-17H,1,3H2,(H,14,18,19)/t5-,6+,7+/m0/s1
    Synonyms
    F3DThd | MFCD00006534 | NCGC00166323-01 | D00391 | F3T | HMS3715C14 | Tox21_112411_1 | TRIFLURIDINE (USP MONOGRAPH) |...
  6. 2'-Deoxyuridine
    CAS: 951-78-0 EC Number: 213-455-7 Formula: C9H12N2O5 Molecular Weight: 228.2
    Solid ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: D100363
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    IUPAC Name
    1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
    SMILES
    C1C(C(OC1N2C=CC(=O)NC2=O)CO)O
    InChIKey
    MXHRCPNRJAMMIM-SHYZEUOFSA-N
    InChI
    1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8+/m0/s1
    Synonyms
    1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil | s5505 | MLS001066344 | bmse000320 | SCHEMBL28844 | 1-(2-Deoxy-ss-D-...
  7. 5'-Deoxy-5-fluorouridine, Thymidylate synthase inhibitor
    CAS: 3094-09-5 EC Number: 221-440-1 Formula: C9H11FN2O5 Molecular Weight: 246.19
    Solid ≥98%(HPLC)
    ● In Stock — US warehouse, ships to EU* Item #: D155744
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    IUPAC Name
    1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoropyrimidine-2,4-dione
    SMILES
    CC1C(C(C(O1)N2C=C(C(=O)NC2=O)F)O)O
    InChIKey
    ZWAOHEXOSAUJHY-ZIYNGMLESA-N
    InChI
    1S/C9H11FN2O5/c1-3-5(13)6(14)8(17-3)12-2-4(10)7(15)11-9(12)16/h2-3,5-6,8,13-14H,1H3,(H,11,15,16)/t3-,5-,6-,8-/m1/s1
    Synonyms
    1-(beta-D-5-Desoxyribofuranoxyl)-5-fluoruracil | EU-0100537 | NCGC00261222-01 | Capecitabine impurity B, European Pha...
  8. 2'-Deoxyuridine
    CAS: 951-78-0 EC Number: 213-455-7 Formula: C9H12N2O5 Molecular Weight: 228.2
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: D427065
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    Technical Identifiers
    IUPAC Name
    1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
    SMILES
    C1C(C(OC1N2C=CC(=O)NC2=O)CO)O
    InChIKey
    MXHRCPNRJAMMIM-SHYZEUOFSA-N
    InChI
    1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8+/m0/s1
    Synonyms
    1-(2-deoxy-beta-D-erythro-pentofuranosyl)uracil | s5505 | MLS001066344 | bmse000320 | SCHEMBL28844 | 1-(2-Deoxy-ss-D-...
  9. TAS-102
    CAS: 733030-01-8 Formula: [C9H11ClN4O2• (HCl)] • 2[ C10H11F3N2O5] Molecular Weight: 871.52
    ● In Stock — US warehouse, ships to EU* Item #: T414046
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    SMILES
    Cl.OCC1OC(CC1O)N2C=C(C(=O)NC2=O)C(F)(F)F.OCC3OC(CC3O)N4C=C(C(=O)NC4=O)C(F)(F)F.ClC5=C(CN6CCCC6=N)NC(=O)NC5=O
    Synonyms
    Tipiracil-trifluridine Mixture (2:1) | trifluridine (TFT) and Tipiracil Hydrochloride (TTP) in molar ratio of 1: 0.5 ...
  10. TAS-102
    CAS: 733030-01-8 Formula: [C9H11ClN4O2• (HCl)] • 2[ C10H11F3N2O5] Molecular Weight: 871.52
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: T425727
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    Synonyms
    Tipiracil-trifluridine Mixture (2:1) | trifluridine (TFT) and Tipiracil Hydrochloride (TTP) in molar ratio of 1: 0.5 ...
  11. plevitrexed, Inhibitor of thymidylate synthetase
    CAS: 153537-73-6 Formula: C26H25FN8O4 Molecular Weight: 532.53
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    ◐ .Made to order · 8–12 wks Item #: P612868
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    IUPAC Name
    (2S)-2-[[4-[(2,7-dimethyl-4-oxo-3H-quinazolin-6-yl)methyl-prop-2-ynylamino]-2-fluorobenzoyl]amino]-4-(2H-tetrazol-5-yl)butanoic acid
    SMILES
    CC1=CC2=C(C=C1CN(CC#C)C3=CC(=C(C=C3)C(=O)NC(CCC4=NNN=N4)C(=O)O)F)C(=O)NC(=N2)C
    InChIKey
    IEJSCSAMMLUINT-NRFANRHFSA-N
    InChI
    1S/C26H25FN8O4/c1-4-9-35(13-16-11-19-22(10-14(16)2)28-15(3)29-25(19)37)17-5-6-18(20(27)12-17)24(36)30-21(26(38)39)7-8-23-31-33-34-32-23/h1,5-6,10-12,2show more
    Synonyms
    (S)-2-{4-[(2,7-Dimethyl-4-oxo-3,4-dihydro-quinazolin-6-ylmethyl)-prop-2-ynyl-amino]-2-fluoro-benzoylamino}-4-(1H-tetr...
  12. tipiracil
    CAS: 183204-74-2 PubChem CID: 6323266
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    ◐ .Made to order · 8–12 wks Item #: T614475
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    IUPAC Name
    5-chloro-6-[(2-iminopyrrolidin-1-yl)methyl]-1H-pyrimidine-2,4-dione
    SMILES
    O=c1[nH]c(CN2CCCC2=N)c(c(=O)[nH]1)Cl
    InChIKey
    QQHMKNYGKVVGCZ-UHFFFAOYSA-N
    InChI
    1S/C9H11ClN4O2/c10-7-5(12-9(16)13-8(7)15)4-14-3-1-2-6(14)11/h11H,1-4H2,(H2,12,13,15,16)
    Synonyms
    5-Chloro-6-((2-iminopyrrolidin-1-yl)methyl)pyrimidine-2,4-(1H,3H)-dione | ALFQ component DMPC | DTXSID601025833 | TIP...
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Frequently Asked Questions

What can I find under Thymidylate Synthase?
This listing collects compounds associated with Thymidylate Synthase within our Apoptosis area — inhibitors, agonists or antagonists, and reference tool compounds. Each entry links to its structure, CAS number, and reported activity so you can confirm the annotation before ordering.
What should I consider when picking a compound for Thymidylate Synthase?
Consider the reported potency of each Thymidylate Synthase compound and the assay behind it, selectivity against closely related targets, cell permeability if you are working in cells, and stability in your buffer. Two chemically distinct compounds giving the same phenotype is much stronger evidence than one.
What quality information is provided for Thymidylate Synthase compounds?
Each Thymidylate Synthase product page lists purity, identity data, molecular formula and weight, and storage conditions, with a lot-specific Certificate of Analysis available. Solubility and handling notes are on the datasheet. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
Can I search Thymidylate Synthase compounds by activity or structure?
Yes. Filter the Thymidylate Synthase listing by mechanism — inhibitor, agonist, antagonist — and search by target name or gene symbol, CAS number, molecular formula, or SMILES to reach exact structures and close analogs. For bulk quantities or items not listed, contact [email protected].

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