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

Systemtic Name: N'-(7-chloranyl-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)-2-propyl-butanediamide Openeye Name: N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-isobutyl-2-propyl-butanediamide CAS Name: N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)-2-propylbutanediamide IUPAC Name: N'-(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(2-methylpropyl)-2-propylbutanediamide Traditional Name: N'-(7-chloro-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-isobutyl-2-propyl-succinamide Formula: C27H33ClN4O3 MolecularWeight: 497.02892

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(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

CCCC(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/C27H33ClN4O3/c1-5-9-19(24(29)33)20(14-16(2)3)26(34)31-25-27(35)32(4)22-13-12-18(28)15-21(22)23(30-25)17-10-7-6-8-11-17/h6-8,10-13,15-16,19-20,25H,5,9,14H2,1-4H3,(H2,29,33)(H,31,34)