2-butyl-N'-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)butanediamide

Systemtic Name: 2-butyl-N'-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)butanediamide Openeye Name: 2-butyl-N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-isobutyl-butanediamide CAS Name: 2-butyl-N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)butanediamide IUPAC Name: 2-butyl-N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)butanediamide Traditional Name: 2-butyl-N'-(7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-isobutyl-succinamide Formula: C28H35ClN4O3 MolecularWeight: 511.0555

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC(C)C)C(=O)NC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)C)C(=O)N

Isomeric SMILES

CCCCC(C(CC(C)C)C(=O)NC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)C)C(=O)N

InChI

InChI=1S/C28H35ClN4O3/c1-5-6-12-20(25(30)34)21(15-17(2)3)27(35)32-26-28(36)33(4)23-14-13-19(29)16-22(23)24(31-26)18-10-8-7-9-11-18/h7-11,13-14,16-17,20-21,26H,5-6,12,15H2,1-4H3,(H2,30,34)(H,32,35)