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Benzodiazepines

Description:

Organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Benzodiazepines

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  1. HZ-166
    HZ-166
    CAS: 612527-56-7 PubChem CID: 10309028
    Out of Stock Item #: H978244
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    Technical Identifiers
    IUPAC Name
    ethyl 8-ethynyl-6-pyridin-2-yl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
    SMILES
    CCOC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=N4
    InChIKey
    ZSEDMNMFODMQRD-UHFFFAOYSA-N
    InChI
    1S/C21H16N4O2/c1-3-14-8-9-17-15(11-14)19(16-7-5-6-10-22-16)23-12-18-20(21(26)27-4-2)24-13-25(17)18/h1,5-11,13H,4,12H2,2H3
  2. HX 600
    HX 600
    CAS: 172705-89-4 PubChem CID: 128016
    ≥99%
    Out of Stock Item #: H1328410
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    IUPAC Name
    4-(5,7,7,10,10-pentamethyl-8,9-dihydronaphtho[2,3-b][1,5]benzodiazepin-12-yl)benzoic acid
    SMILES
    CC1(CCC(C2=C1C=C3C(=C2)N(C4=CC=CC=C4N=C3C5=CC=C(C=C5)C(=O)O)C)(C)C)C
    InChIKey
    DLFBCHSYAZBTSS-UHFFFAOYSA-N
    InChI
    1S/C29H30N2O2/c1-28(2)14-15-29(3,4)22-17-25-20(16-21(22)28)26(18-10-12-19(13-11-18)27(32)33)30-23-8-6-7-9-24(23)31(25)5/h6-13,16-17H,14-15H2,1-5H3,(H,show more
  3. Cinazepam
    Cinazepam
    CAS: 172986-25-3 Formula: C19H14BrClN2O5 Molecular Weight: 465.7
    Out of Stock Item #: C1341633
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    IUPAC Name
    4-[[7-bromo-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-oxobutanoic acid
    SMILES
    C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Br)OC(=O)CCC(=O)O)Cl
    InChIKey
    NQTRBZXDWMDXAQ-UHFFFAOYSA-N
    InChI
    1S/C19H14BrClN2O5/c20-10-5-6-14-12(9-10)17(11-3-1-2-4-13(11)21)23-19(18(27)22-14)28-16(26)8-7-15(24)25/h1-6,9,19H,7-8H2,(H,22,27)(H,24,25)
  4. Adinazolam
    Adinazolam
    CAS: 37115-32-5 PubChem CID: 37632
    ≥99%
    Out of Stock Item #: A1069342
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    IUPAC Name
    1-(8-chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl)-N,N-dimethylmethanamine
    SMILES
    CN(C)CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4
    InChIKey
    GJSLOMWRLALDCT-UHFFFAOYSA-N
    InChI
    1S/C19H18ClN5/c1-24(2)12-18-23-22-17-11-21-19(13-6-4-3-5-7-13)15-10-14(20)8-9-16(15)25(17)18/h3-10H,11-12H2,1-2H3
  5. 7-Amino-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
    7-Amino-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
    CAS: 1215070-96-4 Formula: C15H12ClN3O Molecular Weight: 289.75
    Out of Stock Item #: A1249474
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    Technical Identifiers
    IUPAC Name
    7-amino-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
    SMILES
    [2H]C1=C(C(=C(C(=C1[2H])C2=NCC(=O)NC3=C2C=C(C=C3)N)Cl)[2H])[2H]
    InChIKey
    HEFRPWRJTGLSSV-RHQRLBAQSA-N
    InChI
    1S/C15H12ClN3O/c16-12-4-2-1-3-10(12)15-11-7-9(17)5-6-13(11)19-14(20)8-18-15/h1-7H,8,17H2,(H,19,20)/i1D,2D,3D,4D
  6. 2-[(4R)-6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide
    2-[(4R)-6-(4-Chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide
    CAS: 1260530-25-3 PubChem CID: 52934127
    ≥99%
    Out of Stock Item #: R1340557
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    Technical Identifiers
    IUPAC Name
    2-[(4R)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide
    SMILES
    CCNC(=O)CC1C2=NN=C(N2C3=C(C=C(C=C3)OC)C(=N1)C4=CC=C(C=C4)Cl)C
    InChIKey
    AAAQFGUYHFJNHI-GOSISDBHSA-N
    InChI
    1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m1show more
  7. 4-(4-chlorophenyl)-2-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
    4-(4-chlorophenyl)-2-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
    CAS: 75220-84-7 Formula: C21H17ClN2 Molecular Weight: 332.8
    Out of Stock Item #: C1252910
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    Technical Identifiers
    IUPAC Name
    4-(4-chlorophenyl)-2-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
    SMILES
    C1C(NC2=CC=CC=C2N=C1C3=CC=C(C=C3)Cl)C4=CC=CC=C4
    InChIKey
    HGXLBVMEBUESSS-UHFFFAOYSA-N
    InChI
    1S/C21H17ClN2/c22-17-12-10-16(11-13-17)21-14-20(15-6-2-1-3-7-15)23-18-8-4-5-9-19(18)24-21/h1-13,20,23H,14H2
  8. (R)-2-Methyl-4-(8-methyl-7-(5-methyl-1,3,4-thiadiazol-2-yl)-8,9-dihydro-7H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d][1,2]diazepin-5-yl)aniline
    (R)-2-Methyl-4-(8-methyl-7-(5-methyl-1,3,4-thiadiazol-2-yl)-8,9-dihydro-7H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d][1,2]diazepin-5-yl)aniline
    CAS: 732278-52-3 Formula: C21H21N5O2S Molecular Weight: 407.500
    ≥98%
    Out of Stock Item #: R970318
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    Technical Identifiers
    IUPAC Name
    2-methyl-4-[(8R)-8-methyl-7-(5-methyl-1,3,4-thiadiazol-2-yl)-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl]aniline
    SMILES
    C[C@@H]1CC2=CC3=C(C=C2C(=NN1C4=NN=C(S4)C)C5=CC(=C(C=C5)N)C)OCO3
    InChIKey
    DBDUGNPURSLMPS-GFCCVEGCSA-N
    InChI
    1S/C21H21N5O2S/c1-11-6-14(4-5-17(11)22)20-16-9-19-18(27-10-28-19)8-15(16)7-12(2)26(25-20)21-24-23-13(3)29-21/h4-6,8-9,12H,7,10,22H2,1-3H3/t12-/m1/s1
  9. Sulazepam
    Sulazepam
    CAS: 2898-13-7 Formula: C16H13ClN2S Molecular Weight: 300.81
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    Out of Stock Item #: S1053467
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    Technical Identifiers
    IUPAC Name
    7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepine-2-thione
    SMILES
    CN1C(=S)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3
    InChIKey
    MWGWTOPCKLQYEU-UHFFFAOYSA-N
    InChI
    1S/C16H13ClN2S/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
  10. Nerisopam
    Nerisopam
    CAS: 102771-12-0 Formula: C18H19N3O2 Molecular Weight: 309.4
    Out of Stock Item #: N1347382
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    Technical Identifiers
    IUPAC Name
    4-(7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepin-1-yl)aniline
    SMILES
    CC1=NN=C(C2=CC(=C(C=C2C1)OC)OC)C3=CC=C(C=C3)N
    InChIKey
    WWQDEXGFYVSTCX-UHFFFAOYSA-N
    InChI
    1S/C18H19N3O2/c1-11-8-13-9-16(22-2)17(23-3)10-15(13)18(21-20-11)12-4-6-14(19)7-5-12/h4-7,9-10H,8,19H2,1-3H3
  11. 3-Hydroxyphenazepam
    3-Hydroxyphenazepam
    CAS: 70030-11-4 PubChem CID: 125820 Formula: C15H10BrClN2O2 Molecular Weight: 365.61
    Out of Stock Item #: H1360479
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    Technical Identifiers
    IUPAC Name
    7-bromo-5-(2-chlorophenyl)-3-hydroxy-1,3-dihydro-1,4-benzodiazepin-2-one
    SMILES
    C1=CC=C(C(=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Br)O)Cl
    InChIKey
    KRJKJUWAZOWXNV-UHFFFAOYSA-N
    InChI
    1S/C15H10BrClN2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)
  12. alpha-Hydroxytriazolam
    alpha-Hydroxytriazolam
    CAS: 37115-45-0 PubChem CID: 1963 Formula: C17H12Cl2N4O Molecular Weight: 359.21
    Out of Stock Item #: A1353788
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    Technical Identifiers
    IUPAC Name
    [8-chloro-6-(2-chlorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol
    SMILES
    C1C2=NN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4Cl)CO
    InChIKey
    BHUYWUDMVCLHND-UHFFFAOYSA-N
    InChI
    1S/C17H12Cl2N4O/c18-10-5-6-14-12(7-10)17(11-3-1-2-4-13(11)19)20-8-15-21-22-16(9-24)23(14)15/h1-7,24H,8-9H2
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