N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-4-phenyl-butanamide

Systemtic Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-4-phenyl-butanamide Openeye Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-4-phenyl-butanamide CAS Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-4-phenylbutanamide IUPAC Name: N-[5-[cyclohexyl(methyl)amino]-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-4-phenylbutanamide Traditional Name: N-[5-[cyclohexyl(methyl)amino]-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]-4-phenyl-butyramide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCCC3=CC=CC=C3)N(C)C4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCCC3=CC=CC=C3)N(C)C4CCCCC4

InChI

InChI=1S/C27H34N4O2/c1-30(21-15-7-4-8-16-21)26-22-17-9-10-18-23(22)31(2)27(33)25(29-26)28-24(32)19-11-14-20-12-5-3-6-13-20/h3,5-6,9-10,12-13,17-18,21,25H,4,7-8,11,14-16,19H2,1-2H3,(H,28,32)