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

Systemtic Name: 2-azanyl-N-[3-(1H-indol-3-yl)-1-oxidanylidene-1-[4-(2-phenylbenzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-2-methyl-propanamide Openeye Name: 2-amino-N-[1-(1H-indol-3-ylmethyl)-2-oxo-2-[4-(2-phenylbenzimidazol-1-yl)-1-piperidyl]ethyl]-2-methyl-propanamide CAS Name: 2-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-phenyl-1-benzimidazolyl)-1-piperidinyl]propan-2-yl]-2-methylpropanamide IUPAC Name: 2-amino-N-[3-(1H-indol-3-yl)-1-oxo-1-[4-(2-phenylbenzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-2-methylpropanamide Traditional Name: 2-amino-N-[1-(1H-indol-3-ylmethyl)-2-keto-2-[4-(2-phenylbenzimidazol-1-yl)piperidino]ethyl]-2-methyl-propionamide Formula: C33H36N6O2 MolecularWeight: 548.67794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H36N6O2/c1-33(2,34)32(41)37-28(20-23-21-35-26-13-7-6-12-25(23)26)31(40)38-18-16-24(17-19-38)39-29-15-9-8-14-27(29)36-30(39)22-10-4-3-5-11-22/h3-15,21,24,28,35H,16-20,34H2,1-2H3,(H,37,41)