2-(3-butan-2-yl-7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexyl-ethanamide

Systemtic Name: 2-(3-butan-2-yl-7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexyl-ethanamide Openeye Name: 2-(7-chloro-2-oxo-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexyl-acetamide CAS Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexylacetamide IUPAC Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexylacetamide Traditional Name: 2-(7-chloro-2-keto-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)-N-cyclohexyl-acetamide Formula: C27H32ClN3O2 MolecularWeight: 466.01488

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NC4CCCCC4

Isomeric SMILES

CCC(C)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CC(=O)NC4CCCCC4

InChI

InChI=1S/C27H32ClN3O2/c1-3-18(2)25-27(33)31(17-24(32)29-21-12-8-5-9-13-21)23-15-14-20(28)16-22(23)26(30-25)19-10-6-4-7-11-19/h4,6-7,10-11,14-16,18,21,25H,3,5,8-9,12-13,17H2,1-2H3,(H,29,32)