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

Systemtic Name: 2-(3-butan-2-yl-7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-methylbutyl)ethanamide Openeye Name: 2-(7-chloro-2-oxo-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)-N-isopentyl-acetamide CAS Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-methylbutyl)acetamide IUPAC Name: 2-(3-butan-2-yl-7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-(3-methylbutyl)acetamide Traditional Name: 2-(7-chloro-2-keto-5-phenyl-3-sec-butyl-3H-1,4-benzodiazepin-1-yl)-N-isoamyl-acetamide Formula: C26H32ClN3O2 MolecularWeight: 454.00418

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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)NCCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H32ClN3O2/c1-5-18(4)24-26(32)30(16-23(31)28-14-13-17(2)3)22-12-11-20(27)15-21(22)25(29-24)19-9-7-6-8-10-19/h6-12,15,17-18,24H,5,13-14,16H2,1-4H3,(H,28,31)