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

2-Chloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine
Cas Number: 1977-08-8 Compound CID: 16104

Formula: C₁₈H₁₉ClN₄ Molecular Weight: 326.8

IUPAC Name: 8-chloro-6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine

SMILES: CN1CCN(CC1)C2=NC3=CC=CC=C3NC4=C2C=C(C=C4)Cl

InChIKey: APOMSSAGEAOUGO-UHFFFAOYSA-N

InChI: InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-12-13(19)6-7-15(14)20-16-4-2-3-5-17(16)21-18/h2-7,12,20H,8-11H2,1H3

Synonyms: ISOCLOZAPINE | 2-Chloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine | 4Q6V732VRT | 8-chloro-6-(4-methyl...

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Ethyl 8-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate
Cas Number: 78756-33-9 Compound CID: 114888

Formula: C₁₅H₁₄ClN₃O₃ Molecular Weight: 319.74

IUPAC Name: ethyl 8-chloro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

SMILES: CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)Cl)C

InChIKey: QORLMYYHZLDYOR-UHFFFAOYSA-N

InChI: InChI=1S/C15H14ClN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3

Synonyms: Ethyl 8-chloro-5,6-dihydro-5-methyl-6-oxo-4H-imidazo(1,5-a)(1,4)benzodiazepine-3-carboxylate | ZRD5QFZ6DV | Ro-151310...

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Afizagabar
- ≥98%
Cas Number: 1398496-82-6 Compound CID: 136209703

Formula: C₁₉H₁₂FN₃O₂S Molecular Weight: 365.38

IUPAC Name: 5-(4-fluoro-1-benzothiophen-2-yl)-8-methyl-1,9-dihydro-[1,3]oxazolo[4,5-h][2,3]benzodiazepin-2-one

SMILES: CC1=NN=C(C2=CC3=C(C=C2C1)NC(=O)O3)C4=CC5=C(C=CC=C5S4)F

InChIKey: WNUWGRVHGICCLS-UHFFFAOYSA-N

InChI: InChI=1S/C19H12FN3O2S/c1-9-5-10-6-14-15(25-19(24)21-14)7-11(10)18(23-22-9)17-8-12-13(20)3-2-4-16(12)26-17/h2-4,6-8H,5H2,1H3,(H,21,24)

Synonyms: AT33292 | s44819 | S-44819 | 1398496-82-6 | GLXC-25527 | SCHEMBL12095327 | starbld0002583 | Afizagabar | 5-(4-Fluoro-...
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Nuvenzepine
- ≥99%
Cas Number: 96487-37-5 Compound CID: 65846

Formula: C₁₉H₂₀N₄O₂ Molecular Weight: 336.39

IUPAC Name: 11-(1-methylpiperidine-4-carbonyl)-6H-pyrido[3,2-c][1,5]benzodiazepin-5-one

SMILES: CN1CCC(CC1)C(=O)N2C3=CC=CC=C3NC(=O)C4=C2N=CC=C4

InChIKey: HPKYRXAEGNUARA-UHFFFAOYSA-N

InChI: InChI=1S/C19H20N4O2/c1-22-11-8-13(9-12-22)19(25)23-16-7-3-2-6-15(16)21-18(24)14-5-4-10-20-17(14)23/h2-7,10,13H,8-9,11-12H2,1H3,(H,21,24)

Synonyms: Nuvenzepinum | 11-(1-methylpiperidine-4-carbonyl)-6,11-dihydro-5H-benzo[b]pyrido[2,3-e][1,4]diazepin-5-one | HY-U0011...
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Flumazenil acid
- ≥99%
Cas Number: 84378-44-9 Compound CID: 134757

Formula: C₁₃H₁₀FN₃O₃ Molecular Weight: 275.24

IUPAC Name: 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid

SMILES: CN1CC2=C(N=CN2C3=C(C1=O)C=C(C=C3)F)C(=O)O

InChIKey: SFVXVWJBSJCRJO-UHFFFAOYSA-N

InChI: InChI=1S/C13H10FN3O3/c1-16-5-10-11(13(19)20)15-6-17(10)9-3-2-7(14)4-8(9)12(16)18/h2-4,6H,5H2,1H3,(H,19,20)

Synonyms: 8-Fluoro-5-methyl-6-oxo-5,6-dihydro-4H-benzo[f]imidazo[1,5-a][1,4]diazepine-3-carboxylic acid | DTXSID60233357 | 2- A...
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RSV604 racemate
- ≥98%
Cas Number: 676128-62-4 Compound CID: 5279171

Formula: C₂₂H₁₇FN₄O₂ Molecular Weight: 388.39

IUPAC Name: 1-(2-fluorophenyl)-3-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)urea

SMILES: C1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)NC(=O)NC4=CC=CC=C4F

InChIKey: MTPVBMVUENFFLL-UHFFFAOYSA-N

InChI: InChI=1S/C22H17FN4O2/c23-16-11-5-7-13-18(16)25-22(29)27-20-21(28)24-17-12-6-4-10-15(17)19(26-20)14-8-2-1-3-9-14/h1-13,20H,(H,24,28)(H2,25,27,29)
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Demoxepam
- ≥99%
Cas Number: 963-39-3 Compound CID: 13756

Formula: C₁₅H₁₁ClN₂O₂ Molecular Weight: 286.72

IUPAC Name: 7-chloro-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-one

SMILES: C1C(=O)N=C2C=CC(=CC2=C(N1O)C3=CC=CC=C3)Cl

InChIKey: PSADRZMLSXCSAS-UHFFFAOYSA-N

InChI: InChI=1S/C15H11ClN2O2/c16-11-6-7-13-12(8-11)15(10-4-2-1-3-5-10)18(20)9-14(19)17-13/h1-8,20H,9H2

Synonyms: 7-chloro-4-oxido-5-phenyl-1,3-dihydro-1,4-benzodiazepin-4-ium-2-one | Demoxepam 1.0 mg/ml in Methanol | 7-Chloro-5-ph...
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Deschloroclozapine
- ≥99%
Cas Number: 1977-07-7 Compound CID: 16103

Formula: C₁₈H₂₀N₄ Molecular Weight: 292.4

IUPAC Name: 6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine

SMILES: CN1CCN(CC1)C2=NC3=CC=CC=C3NC4=CC=CC=C42

InChIKey: VQHITFFJBFOMBG-UHFFFAOYSA-N

InChI: InChI=1S/C18H20N4/c1-21-10-12-22(13-11-21)18-14-6-2-3-7-15(14)19-16-8-4-5-9-17(16)20-18/h2-9,19H,10-13H2,1H3

Synonyms: BRN 0761696 | C18H20N4 | C73760 | VQHITFFJBFOMBG-UHFFFAOYSA-N | Deschloroclozapine | HB8555 | 6-(4-methylpiperazin-1-...
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LIT-001
- ≥98%
Cas Number: 2245072-21-1 Compound CID: 145711713

Formula: C₃₀H₃₄F₃N₇O₄S Molecular Weight: 645.7

IUPAC Name: (2S)-2-(dimethylcarbamothioyl)-N-[[2-methyl-4-(1-methyl-4,10-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]pyrrolidine-1-carboxamshow more

SMILES: CC1=C(C=CC(=C1)C(=O)N2CC3=C(NC4=CC=CC=C42)N(N=C3)C)CNC(=O)N5CCCC5C(=S)N(C)C.C(=O)(C(F)(F)F)O

InChIKey: BZHSRXWFCSEPQQ-JIDHJSLPSA-N

InChI: InChI=1S/C28H33N7O2S.C2HF3O2/c1-18-14-19(11-12-20(18)15-29-28(37)34-13-7-10-24(34)27(38)32(2)3)26(36)35-17-21-16-30-33(4)25(21)31-22-8-5-6-9-23(22)35;show more
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(Rac)-Sograzepide
- ≥98%
Cas Number: 168161-71-5 Compound CID: 21842392

Formula: C₂₈H₃₀N₆O₃ Molecular Weight: 498.58

IUPAC Name: 1-[1-(3,3-dimethyl-2-oxobutyl)-2-oxo-5-pyridin-2-yl-3H-1,4-benzodiazepin-3-yl]-3-[3-(methylamino)phenyl]urea

SMILES: CC(C)(C)C(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)NC)C4=CC=CC=N4

InChIKey: YDZYKNJZCVIKPP-UHFFFAOYSA-N

InChI: InChI=1S/C28H30N6O3/c1-28(2,3)23(35)17-34-22-14-6-5-12-20(22)24(21-13-7-8-15-30-21)32-25(26(34)36)33-27(37)31-19-11-9-10-18(16-19)29-4/h5-16,25,29H,17show more
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GSK-3 inhibitor 1
- ≥98%
Cas Number: 603272-51-1 Compound CID: 78357782

Formula: C₂₂H₁₇ClFN₅O₂ Molecular Weight: 437.85

IUPAC Name: 3-(6-fluoro-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl)-4-imidazo[1,2-a]pyridin-3-ylpyrrole-2,5-dione;hydrochloride

SMILES: C1CN2C=C(C3=CC(=CC(=C32)CN1)F)C4=C(C(=O)NC4=O)C5=CN=C6N5C=CC=C6.Cl

InChIKey: CXXAOCQHGIGIBJ-UHFFFAOYSA-N

InChI: InChI=1S/C22H16FN5O2.ClH/c23-13-7-12-9-24-4-6-27-11-15(14(8-13)20(12)27)18-19(22(30)26-21(18)29)16-10-25-17-3-1-2-5-28(16)17;/h1-3,5,7-8,10-11,24H,4,6show more
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SG2057
- ≥98%
Cas Number: 260417-62-7 Compound CID: 9938287

Formula: C₃₃H₃₆N₄O₆ Molecular Weight: 584.66

SMILES: COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)OCCCCCOC4=C(C=C5C(=C4)N=C[C@@H]6CC(=C)CN6C5=O)OC
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