2-azanyl-N-[1-(1-azanyl-3-methyl-1-oxidanylidene-2-phenyl-butan-2-yl)-2-oxidanylidene-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chloranyl-benzamide

Systemtic Name: 2-azanyl-N-[1-(1-azanyl-3-methyl-1-oxidanylidene-2-phenyl-butan-2-yl)-2-oxidanylidene-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chloranyl-benzamide Openeye Name: 2-amino-N-[1-(1-carbamoyl-2-methyl-1-phenyl-propyl)-2-oxo-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chloro-benzamide CAS Name: 2-amino-N-[1-(1-amino-3-methyl-1-oxo-2-phenylbutan-2-yl)-2-oxo-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chlorobenzamide IUPAC Name: 2-amino-N-[1-(1-amino-3-methyl-1-oxo-2-phenylbutan-2-yl)-2-oxo-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chlorobenzamide Traditional Name: 2-amino-N-[1-(1-carbamoyl-2-methyl-1-phenyl-propyl)-2-keto-5,5-diphenyl-3,4-dihydro-1,4-benzodiazepin-3-yl]-4-chloro-benzamide Formula: C39H36ClN5O3 MolecularWeight: 658.18784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)(C(=O)N)N2C3=CC=CC=C3C(NC(C2=O)NC(=O)C4=C(C=C(C=C4)Cl)N)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)C(C1=CC=CC=C1)(C(=O)N)N2C3=CC=CC=C3C(NC(C2=O)NC(=O)C4=C(C=C(C=C4)Cl)N)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H36ClN5O3/c1-25(2)39(37(42)48,28-18-10-5-11-19-28)45-33-21-13-12-20-31(33)38(26-14-6-3-7-15-26,27-16-8-4-9-17-27)44-34(36(45)47)43-35(46)30-23-22-29(40)24-32(30)41/h3-25,34,44H,41H2,1-2H3,(H2,42,48)(H,43,46)