4-acetamido-N-[(2S)-3-(1H-indol-3-yl)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl]-4-phenyl-piperidine-1-carboxamide

Systemtic Name: 4-acetamido-N-[(2S)-3-(1H-indol-3-yl)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl]-4-phenyl-piperidine-1-carboxamide Openeye Name: 4-acetamido-N-[(1S)-2-[benzyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxamide CAS Name: 4-acetamido-N-[(2S)-3-(1H-indol-3-yl)-1-[methyl-(phenylmethyl)amino]-1-oxopropan-2-yl]-4-phenyl-1-piperidinecarboxamide IUPAC Name: 4-acetamido-N-[(2S)-1-[benzyl(methyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-phenylpiperidine-1-carboxamide Traditional Name: 4-acetamido-N-[(1S)-2-[benzyl(methyl)amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-4-phenyl-piperidine-1-carboxamide Formula: C33H37N5O3 MolecularWeight: 551.67858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(CCN(CC1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N(C)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1(CCN(CC1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)N(C)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H37N5O3/c1-24(39)36-33(27-13-7-4-8-14-27)17-19-38(20-18-33)32(41)35-30(21-26-22-34-29-16-10-9-15-28(26)29)31(40)37(2)23-25-11-5-3-6-12-25/h3-16,22,30,34H,17-21,23H2,1-2H3,(H,35,41)(H,36,39)/t30-/m0/s1