3-azanyl-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one CAS Name: 3-amino-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-3-[2-(1H-indol-3-yl)ethyl]-5-phenyl-1H-1,4-benzodiazepin-2-one Formula: C25H22N4O MolecularWeight: 394.46838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)(CCC4=CNC5=CC=CC=C54)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)(CCC4=CNC5=CC=CC=C54)N

InChI

InChI=1S/C25H22N4O/c26-25(15-14-18-16-27-21-12-6-4-10-19(18)21)24(30)28-22-13-7-5-11-20(22)23(29-25)17-8-2-1-3-9-17/h1-13,16,27H,14-15,26H2,(H,28,30)