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Pyrimidines and pyrimidine derivatives

Description:

Compounds containing a pyrimidne ring, which is a six-member aromatic heterocycle which consists of two nitrogen atoms (at positions 1 and 3) and four carbon atoms.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Diazines ⮕ Pyrimidines and pyrimidine derivatives

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  1. Ethyl 4-hydroxy-2-phenylpyrimidine-5-carboxylate
    Ethyl 4-hydroxy-2-phenylpyrimidine-5-carboxylate
    CAS: 55613-22-4 Formula: C13H12N2O3 Molecular Weight: 244.25
    Solid ≥98%
    Out of Stock Item #: E1073478
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    Technical Identifiers
    IUPAC Name
    ethyl 6-oxo-2-phenyl-1H-pyrimidine-5-carboxylate
    SMILES
    CCOC(=O)C1=CN=C(NC1=O)C2=CC=CC=C2
    InChIKey
    JSIHCFJCICVJHJ-UHFFFAOYSA-N
    InChI
    1S/C13H12N2O3/c1-2-18-13(17)10-8-14-11(15-12(10)16)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,14,15,16)
  2. 2-Amino-4-hydroxy-6-ethylpyrimidine
    2-Amino-4-hydroxy-6-ethylpyrimidine
    CAS: 5734-66-7 PubChem CID: 135481114 Formula: C6H9N3O Molecular Weight: 139.16
    Solid ≥97%
    In Stock Item #: A1369541
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    Technical Identifiers
    IUPAC Name
    2-amino-4-ethyl-1H-pyrimidin-6-one
    SMILES
    CCC1=CC(=O)NC(=N1)N
    InChIKey
    QDSSWFSXBZSFQO-UHFFFAOYSA-N
    InChI
    1S/C6H9N3O/c1-2-4-3-5(10)9-6(7)8-4/h3H,2H2,1H3,(H3,7,8,9,10)
    Synonyms
    4(1H)-Pyrimidinone,2-amino-6-ethyl-(9CI) | 2-AMINO-6-ETHYL-4(1H)-PYRIMIDINONE | 2-Amino-4-hydroxy-6-ethylpyrimidine |...
  3. Ribocil-C
    Ribocil-C
    CAS: 1825355-56-3 PubChem CID: 136981150 Formula: C21H21N7OS Molecular Weight: 419.5
    ≥99%
    Out of Stock Item #: R993927
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    IUPAC Name
    2-[(3S)-1-[(1-pyrimidin-2-ylimidazol-4-yl)methyl]piperidin-3-yl]-4-thiophen-2-yl-1H-pyrimidin-6-one
    SMILES
    C1CC(CN(C1)CC2=CN(C=N2)C3=NC=CC=N3)C4=NC(=CC(=O)N4)C5=CC=CS5
    InChIKey
    UVDVCDUBJWYRJW-HNNXBMFYSA-N
    InChI
    1S/C21H21N7OS/c29-19-10-17(18-5-2-9-30-18)25-20(26-19)15-4-1-8-27(11-15)12-16-13-28(14-24-16)21-22-6-3-7-23-21/h2-3,5-7,9-10,13-15H,1,4,8,11-12H2,(H,2show more
  4. 5-[3-(Diethylaminomethyl)-1-octylindol-5-yl]pyrimidin-2-amine
    5-[3-(Diethylaminomethyl)-1-octylindol-5-yl]pyrimidin-2-amine
    CAS: 1443253-20-0 Formula: C25H37N5 Molecular Weight: 407.6
    Out of Stock Item #: D1239748
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    Technical Identifiers
    IUPAC Name
    5-[3-(diethylaminomethyl)-1-octylindol-5-yl]pyrimidin-2-amine
    SMILES
    CCCCCCCCN1C=C(C2=C1C=CC(=C2)C3=CN=C(N=C3)N)CN(CC)CC
    InChIKey
    HKAUEDVXIIXVGY-UHFFFAOYSA-N
    InChI
    1S/C25H37N5/c1-4-7-8-9-10-11-14-30-19-22(18-29(5-2)6-3)23-15-20(12-13-24(23)30)21-16-27-25(26)28-17-21/h12-13,15-17,19H,4-11,14,18H2,1-3H3,(H2,26,27,2show more
  5. 5-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
    5-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
    CAS: 302826-61-5 PubChem CID: 1102776
    ≥98%
    Out of Stock Item #: D1292468
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    IUPAC Name
    5-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
    SMILES
    C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)C=C3C(=O)NC(=S)NC3=O
    InChIKey
    QQAOFKJHOUFHKI-UHFFFAOYSA-N
    InChI
    1S/C15H8Cl2N2O3S/c16-7-1-3-9(11(17)5-7)12-4-2-8(22-12)6-10-13(20)18-15(23)19-14(10)21/h1-6H,(H2,18,19,20,21,23)
  6. 4-Amino-2-oxo-1,2-dihydropyrimidine-5-carbaldehyde - CAS No(4425-59-6) by Aladdin Scientific
    5-Formylcytosine
    CAS: 4425-59-6 EC Number: 994-504-6 PubChem CID: 10986305 Formula: C5H5N3O2 Molecular Weight: 139.11
    Solid ≥95%
    Out of Stock Item #: A1044153
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    IUPAC Name
    6-amino-2-oxo-1H-pyrimidine-5-carbaldehyde
    SMILES
    C1=NC(=O)NC(=C1C=O)N
    InChIKey
    FHSISDGOVSHJRW-UHFFFAOYSA-N
    InChI
    1S/C5H5N3O2/c6-4-3(2-9)1-7-5(10)8-4/h1-2H,(H3,6,7,8,10)
    Synonyms
    6-Amino-2-oxo-1,2-dihydropyrimidine-5-carbaldehyde | 6-amino-2-oxo-1H-pyrimidine-5-carbaldehyde | 5-Formyl-6-amino-2,...
  7. 2-Selenouracil
    2-Selenouracil
    CAS: 16724-03-1 Formula: C4H3N2OSe Molecular Weight: 174.05
    ≥98%
    Out of Stock Item #: S1307788
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    Technical Identifiers
    SMILES
    C1=CN=C(NC1=O)[Se]
    InChIKey
    DORROJBNUAGYSZ-UHFFFAOYSA-N
    InChI
    1S/C4H3N2OSe/c7-3-1-2-5-4(8)6-3/h1-2H,(H,5,6,7)
  8. Syk Inhibitor IV, BAY 61-3606
    Syk Inhibitor IV, BAY 61-3606
    CAS: 1615197-10-8 PubChem CID: 52949496 Formula: C20H18N6O3•HCl Molecular Weight: 390.403646
    ≥98%
    Out of Stock Item #: S1288909
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    IUPAC Name
    2-[[7-(3,4-dimethoxyphenyl)imidazo[1,2-c]pyrimidin-5-yl]amino]pyridine-3-carboxamide;hydrochloride
    SMILES
    COC1=C(C=C(C=C1)C2=CC3=NC=CN3C(=N2)NC4=C(C=CC=N4)C(=O)N)OC.Cl
    InChIKey
    HLYFDKZWVIBYKL-UHFFFAOYSA-N
    InChI
    1S/C20H18N6O3.ClH/c1-28-15-6-5-12(10-16(15)29-2)14-11-17-22-8-9-26(17)20(24-14)25-19-13(18(21)27)4-3-7-23-19;/h3-11H,1-2H3,(H2,21,27)(H,23,24,25);1H
  9. Tegafur-Uracil
    Tegafur-Uracil
    CAS: 74578-38-4 PubChem CID: 104747
    ≥99%
    Out of Stock Item #: T1019205
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    IUPAC Name
    5-fluoro-1-(oxolan-2-yl)pyrimidine-2,4-dione;1H-pyrimidine-2,4-dione
    SMILES
    C1CC(OC1)N2C=C(C(=O)NC2=O)F.C1=CNC(=O)NC1=O
    InChIKey
    DHMYGZIEILLVNR-UHFFFAOYSA-N
    InChI
    1S/C8H9FN2O3.C4H4N2O2/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12;7-3-1-2-5-4(8)6-3/h4,6H,1-3H2,(H,10,12,13);1-2H,(H2,5,6,7,8)
  10. Sparsomycin
    Sparsomycin
    CAS: 1404-64-4 PubChem CID: 447106
    ≥99%
    Out of Stock Item #: S1293046
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    Technical Identifiers
    IUPAC Name
    (E)-N-[(2S)-1-hydroxy-3-(methylsulfanylmethylsulfinyl)propan-2-yl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
    SMILES
    CC1=C(C(=O)NC(=O)N1)C=CC(=O)NC(CO)CS(=O)CSC
    InChIKey
    XKLZIVIOZDNKEQ-RVUDUMFNSA-N
    InChI
    1S/C13H19N3O5S2/c1-8-10(12(19)16-13(20)14-8)3-4-11(18)15-9(5-17)6-23(21)7-22-2/h3-4,9,17H,5-7H2,1-2H3,(H,15,18)(H2,14,16,19,20)/b4-3+/t9-,23?/m0/s1
  11. N-[2-(Dimethylamino)ethyl]-2-(1,1-dimethylethyl)-7-(4-fluorophenyl)-N-(phenylmethyl)-pyrazolo[1,5-a]pyrimidine-5-carboxamide
    N-[2-(Dimethylamino)ethyl]-2-(1,1-dimethylethyl)-7-(4-fluorophenyl)-N-(phenylmethyl)-pyrazolo[1,5-a]pyrimidine-5-carboxamide
    CAS: 1314206-29-5 Formula: C28H32FN5O Molecular Weight: 473.6
    Out of Stock Item #: N1240517
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    IUPAC Name
    N-benzyl-2-tert-butyl-N-[2-(dimethylamino)ethyl]-7-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
    SMILES
    CC(C)(C)C1=NN2C(=CC(=NC2=C1)C(=O)N(CCN(C)C)CC3=CC=CC=C3)C4=CC=C(C=C4)F
    InChIKey
    GMFHHCFJJZWFBW-UHFFFAOYSA-N
    InChI
    1S/C28H32FN5O/c1-28(2,3)25-18-26-30-23(17-24(34(26)31-25)21-11-13-22(29)14-12-21)27(35)33(16-15-32(4)5)19-20-9-7-6-8-10-20/h6-14,17-18H,15-16,19H2,1-5show more
  12. Hydroxy Desmethyl Bosentan
    Hydroxy Desmethyl Bosentan
    CAS: 253688-62-9 PubChem CID: 6426757
    Out of Stock Item #: H1055776
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    Technical Identifiers
    IUPAC Name
    N-[6-(2-hydroxyethoxy)-5-(2-hydroxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]-4-(1-hydroxy-2-methylpropan-2-yl)benzenesulfonamide
    SMILES
    CC(C)(CO)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4O
    InChIKey
    JXXCMZWROOURSZ-UHFFFAOYSA-N
    InChI
    1S/C26H27N5O7S/c1-26(2,16-33)17-8-10-18(11-9-17)39(35,36)31-22-21(38-20-7-4-3-6-19(20)34)25(37-15-14-32)30-24(29-22)23-27-12-5-13-28-23/h3-13,32-34H,1show more
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