N-[[3-(aminomethyl)cyclohexyl]methyl]-4-oxidanylidene-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-oxidanylidene-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-oxo-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-oxo-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-oxo-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-keto-2-phenyl-1,2,3,5-tetrahydro-1,5-benzodiazepine-7-carboxamide Formula: C24H30N4O2 MolecularWeight: 406.5206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CNC(=O)C2=CC3=C(C=C2)NC(CC(=O)N3)C4=CC=CC=C4)CN

Isomeric SMILES

C1CC(CC(C1)CNC(=O)C2=CC3=C(C=C2)NC(CC(=O)N3)C4=CC=CC=C4)CN

InChI

InChI=1S/C24H30N4O2/c25-14-16-5-4-6-17(11-16)15-26-24(30)19-9-10-20-22(12-19)28-23(29)13-21(27-20)18-7-2-1-3-8-18/h1-3,7-10,12,16-17,21,27H,4-6,11,13-15,25H2,(H,26,30)(H,28,29)