3-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[4-(2-phenylbenzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-3-methyl-butanamide

Systemtic Name: 3-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[4-(2-phenylbenzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-3-methyl-butanamide Openeye Name: 3-amino-N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-[4-(2-phenylbenzimidazol-1-yl)-1-piperidyl]ethyl]-3-methyl-butanamide CAS Name: 3-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-phenyl-1-benzimidazolyl)-1-piperidinyl]propan-2-yl]-3-methylbutanamide IUPAC Name: 3-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-phenylbenzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-3-methylbutanamide Traditional Name: 3-amino-N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(2-phenylbenzimidazol-1-yl)piperidino]ethyl]-3-methyl-butyramide Formula: C34H38N6O2 MolecularWeight: 562.70452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=CC=CC=C5N=C4C6=CC=CC=C6)N

Isomeric SMILES

CC(C)(CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCC(CC3)N4C5=CC=CC=C5N=C4C6=CC=CC=C6)N

InChI

InChI=1S/C34H38N6O2/c1-34(2,35)21-31(41)37-29(20-24-22-36-27-13-7-6-12-26(24)27)33(42)39-18-16-25(17-19-39)40-30-15-9-8-14-28(30)38-32(40)23-10-4-3-5-11-23/h3-15,22,25,29,36H,16-21,35H2,1-2H3,(H,37,41)