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

(7-Chloro-2，3-Dihydro-2-Oxo-5-Phenyl-1H-Benzo-1，4-Diazepin-3-Yl) Hydrogen Succinate
- ≥95%
Cas Number: 4700-56-5

Formula: C₁₉H₁₅ClN₂O₅ Molecular Weight: 386.7858

SMILES: C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)OC(=O)CCC(=O)O

InChIKey: UCUOKZUJHTYPJT-UHFFFAOYSA-N

InChI: InChI=1S/C19H15ClN2O5/c20-12-6-7-14-13(10-12)17(11-4-2-1-3-5-11)22-19(18(26)21-14)27-16(25)9-8-15(23)24/h1-7,10,19H,8-9H2,(H,21,26)(H,23,24)
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Bretazenil
- ≥97%
Cas Number: 84379-13-5 Compound CID: 107926

Formula: C₁₉H₂₀BrN₃O₃ Molecular Weight: 418.28

IUPAC Name: tert-butyl (7S)-14-bromo-12-oxo-2,4,11-triazatetracyclo[11.4.0.02,6.07,11]heptadeca-1(17),3,5,13,15-pentaene-5-carboxylate

SMILES: CC(C)(C)OC(=O)C1=C2C3CCCN3C(=O)C4=C(N2C=N1)C=CC=C4Br

InChIKey: LWUDDYHYYNNIQI-ZDUSSCGKSA-N

InChI: InChI=1S/C19H20BrN3O3/c1-19(2,3)26-18(25)15-16-13-8-5-9-22(13)17(24)14-11(20)6-4-7-12(14)23(16)10-21-15/h4,6-7,10,13H,5,8-9H2,1-3H3/t13-/m0/s1
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3-[(S)-7-bromo-2-oxo-5-pyridin-2-yl-2，3-dihydro-1H-1，4-benzodiazepin-3-yl]-propionic acid methyl ester
- ≥98%
Cas Number: 308242-23-1

Formula: C₁₈H₁₆BrN₃O₃ Molecular Weight: 402.24

IUPAC Name: methyl 3-[(3S)-7-bromo-2-oxo-5-pyridin-2-yl-1,3-dihydro-1,4-benzodiazepin-3-yl]propanoate

SMILES: COC(=O)CCC1C(=O)NC2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=N3

InChIKey: PITXBYGUVDYTBQ-HNNXBMFYSA-N

InChI: InChI=1S/C18H16BrN3O3/c1-25-16(23)8-7-15-18(24)22-13-6-5-11(19)10-12(13)17(21-15)14-4-2-3-9-20-14/h2-6,9-10,15H,7-8H2,1H3,(H,22,24)/t15-/m0/s1

Synonyms: (S)-Methyl 3-(7-bromo-2-oxo-5-(pyridin-2-yl)-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)propanoate | 1H-1,4-Benzodiaze...
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Pricing Close
7-Bromo-4-methyl-3，4-dihydro-1H-benzo[e][1，4]diazepine-2，5-dione
- ≥95%
Cas Number: 78756-36-2 Compound CID: 5297644

Formula: C₁₀H₉BrN₂O₂ Molecular Weight: 269.09

IUPAC Name: 7-bromo-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione

SMILES: CN1CC(=O)NC2=C(C1=O)C=C(C=C2)Br

InChIKey: KKJBJTGEGMJZCG-UHFFFAOYSA-N

InChI: InChI=1S/C10H9BrN2O2/c1-13-5-9(14)12-8-3-2-6(11)4-7(8)10(13)15/h2-4H,5H2,1H3,(H,12,14)
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10，11-Dihydro-5H-benzo[e]pyrrolo[1，2-a][1，4]diazepine
- ≥95%
Cas Number: 22162-53-4 Compound CID: 15547048

Formula: C₁₂H₁₂N₂ Molecular Weight: 184.24

IUPAC Name: 6,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine

SMILES: C1C2=CC=CN2CC3=CC=CC=C3N1

InChIKey: POAQFKSUTQWHMZ-UHFFFAOYSA-N

InChI: InChI=1S/C12H12N2/c1-2-6-12-10(4-1)9-14-7-3-5-11(14)8-13-12/h1-7,13H,8-9H2
Details

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1-Methyl-3，4-dihydro-1H-benzo[e][1，4]diazepine-2，5-dione
- ≥95%
Cas Number: 1133-42-2 Compound CID: 3562387

Formula: C₁₀H₁₀N₂O₂ Molecular Weight: 190.2

IUPAC Name: 1-methyl-3,4-dihydro-1,4-benzodiazepine-2,5-dione

SMILES: CN1C(=O)CNC(=O)C2=CC=CC=C21

InChIKey: MUESRUHFMTYDIT-UHFFFAOYSA-N

InChI: InChI=1S/C10H10N2O2/c1-12-8-5-3-2-4-7(8)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)
Details

Pricing Close
tert-Butyl 7-bromo-2，3-dihydro-1H-benzo[e][1，4]diazepine-4(5H)-carboxylate
- ≥97%
Cas Number: 886364-30-3 Compound CID: 25417642

Formula: C₁₄H₁₉BrN₂O₂ Molecular Weight: 327.222

IUPAC Name: tert-butyl 7-bromo-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate

SMILES: CC(C)(C)OC(=O)N1CCNC2=C(C1)C=C(C=C2)Br

InChIKey: XTVVPYZXTUZWFG-UHFFFAOYSA-N

InChI: InChI=1S/C14H19BrN2O2/c1-14(2,3)19-13(18)17-7-6-16-12-5-4-11(15)8-10(12)9-17/h4-5,8,16H,6-7,9H2,1-3H3
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5，10-Dihydro-2-methyl-4H-thieno[2，3-b][1，5]benzodiazepin-4-one
- ≥98%
Cas Number: 221176-49-4 Compound CID: 29978685

Formula: C₁₂H₁₀N₂OS Molecular Weight: 230.29

IUPAC Name: 2-methyl-5,10-dihydrothieno[3,2-c][1,5]benzodiazepin-4-one

SMILES: CC1=CC2=C(S1)NC3=CC=CC=C3NC2=O

InChIKey: LVTDAJJOMLNXFS-UHFFFAOYSA-N

InChI: InChI=1S/C12H10N2OS/c1-7-6-8-11(15)13-9-4-2-3-5-10(9)14-12(8)16-7/h2-6,14H,1H3,(H,13,15)
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Pricing Close
3，4-Dihydro-1H-benzo[e][1，4]diazepin-5(2H)-one
- ≥97%
Cas Number: 28544-83-4 Compound CID: 13703324

Formula: C₉H₁₀N₂O Molecular Weight: 162.19

IUPAC Name: 1,2,3,4-tetrahydro-1,4-benzodiazepin-5-one

SMILES: C1CNC(=O)C2=CC=CC=C2N1

InChIKey: WCNVOWWRJIZZKA-UHFFFAOYSA-N

InChI: InChI=1S/C9H10N2O/c12-9-7-3-1-2-4-8(7)10-5-6-11-9/h1-4,10H,5-6H2,(H,11,12)
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N-Desmethylclobazam (nor-Clobazam)
- ≥98%
Cas Number: 22316-55-8 EC Number: 244-909-2 Compound CID: 89657

IUPAC Name: 7-chloro-5-phenyl-1H-1,5-benzodiazepine-2,4-dione

SMILES: C1C(=O)NC2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3

InChIKey: RRTVVRIFVKKTJK-UHFFFAOYSA-N

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

Pricing Close
3,4-Dihydro-1H-1,4-benzodiazepine-2,5-dione
- ≥98%
Cas Number: 5118-94-5 Compound CID: 600572

Formula: C₉H₈N₂O₂ Molecular Weight: 176.18

IUPAC Name: 3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione

SMILES: C1C(=O)NC2=CC=CC=C2C(=O)N1

InChIKey: AZHGGDCFQPMANU-UHFFFAOYSA-N

InChI: InChI=1S/C9H8N2O2/c12-8-5-10-9(13)6-3-1-2-4-7(6)11-8/h1-4H,5H2,(H,10,13)(H,11,12)

Synonyms: 3,4-Dihydro-1H-benzo[e][1,4]diazepine-2,5-dione
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alpha-Hydroxyalprazolam solution
- 1.0 mg/mL in methanol
Cas Number: 37115-43-8 Compound CID: 162244

Formula: C₁₇H₁₃ClN₄O Molecular Weight: 324.76

IUPAC Name: (8-chloro-6-phenyl-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=C4)CO

InChIKey: ZURUZYHEEMDQBU-UHFFFAOYSA-N

InChI: InChI=1S/C17H13ClN4O/c18-12-6-7-14-13(8-12)17(11-4-2-1-3-5-11)19-9-15-20-21-16(10-23)22(14)15/h1-8,23H,9-10H2
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