3-(1H-indol-3-yl)-2-[2-(4-piperidin-1-ylpiperidin-1-yl)ethanoylamino]-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-2-[2-(4-piperidin-1-ylpiperidin-1-yl)ethanoylamino]-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide Openeye Name: 3-(1H-indol-3-yl)-2-[[2-[4-(1-piperidyl)-1-piperidyl]acetyl]amino]-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide CAS Name: 3-(1H-indol-3-yl)-2-[[1-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]ethyl]amino]-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide IUPAC Name: 3-(1H-indol-3-yl)-2-[[2-(4-piperidin-1-ylpiperidin-1-yl)acetyl]amino]-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(4-piperidinopiperidino)acetyl]amino]-N-(3,4,5-trimethoxybenzyl)propionamide Formula: C33H45N5O5 MolecularWeight: 591.7409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCC(CC4)N5CCCCC5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)CN4CCC(CC4)N5CCCCC5

InChI

InChI=1S/C33H45N5O5/c1-41-29-17-23(18-30(42-2)32(29)43-3)20-35-33(40)28(19-24-21-34-27-10-6-5-9-26(24)27)36-31(39)22-37-15-11-25(12-16-37)38-13-7-4-8-14-38/h5-6,9-10,17-18,21,25,28,34H,4,7-8,11-16,19-20,22H2,1-3H3,(H,35,40)(H,36,39)