N-butyl-2-[3-(2-methylpropyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[3-(2-methylpropyl)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanamide Openeye Name: N-butyl-2-(3-isobutyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide CAS Name: N-butyl-2-[3-(2-methylpropyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetamide IUPAC Name: N-butyl-2-[3-(2-methylpropyl)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetamide Traditional Name: N-butyl-2-(3-isobutyl-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)CC(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)CC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O2/c1-4-5-15-26-23(29)17-28-22-14-10-9-13-20(22)24(19-11-7-6-8-12-19)27-21(25(28)30)16-18(2)3/h6-14,18,21H,4-5,15-17H2,1-3H3,(H,26,29)