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

Systemtic Name: N-butyl-2-(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanamide Openeye Name: N-butyl-2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide CAS Name: N-butyl-2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide IUPAC Name: N-butyl-2-(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Traditional Name: N-butyl-2-(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O2/c1-2-3-11-23-19(26)14-25-18-10-9-16(22)12-17(18)21(24-13-20(25)27)15-7-5-4-6-8-15/h4-10,12H,2-3,11,13-14H2,1H3,(H,23,26)