N-ethanoyl-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]-2-[2-(4-piperidin-1-ylpiperidin-1-yl)ethanoylamino]propanamide

Systemtic Name: N-ethanoyl-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]-2-[2-(4-piperidin-1-ylpiperidin-1-yl)ethanoylamino]propanamide Openeye Name: N-acetyl-3-(1H-indol-3-yl)-N-(o-tolylmethyl)-2-[[2-[4-(1-piperidyl)-1-piperidyl]acetyl]amino]propanamide CAS Name: N-acetyl-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]-2-[[1-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]ethyl]amino]propanamide IUPAC Name: N-acetyl-3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]-2-[[2-(4-piperidin-1-ylpiperidin-1-yl)acetyl]amino]propanamide Traditional Name: N-acetyl-3-(1H-indol-3-yl)-N-(2-methylbenzyl)-2-[[2-(4-piperidinopiperidino)acetyl]amino]propionamide Formula: C33H43N5O3 MolecularWeight: 557.72622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCC(CC4)N5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1CN(C(=O)C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C33H43N5O3/c1-24-10-4-5-11-26(24)22-38(25(2)39)33(41)31(20-27-21-34-30-13-7-6-12-29(27)30)35-32(40)23-36-18-14-28(15-19-36)37-16-8-3-9-17-37/h4-7,10-13,21,28,31,34H,3,8-9,14-20,22-23H2,1-2H3,(H,35,40)