2-(1-naphthalen-2-ylsulfonyl-3-oxidanylidene-piperazin-2-yl)-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]ethanamide

Systemtic Name: 2-(1-naphthalen-2-ylsulfonyl-3-oxidanylidene-piperazin-2-yl)-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]ethanamide Openeye Name: 2-[1-(2-naphthylsulfonyl)-3-oxo-piperazin-2-yl]-N-[[1-(4-pyridyl)-4-piperidyl]methyl]acetamide CAS Name: 2-[1-(2-naphthalenylsulfonyl)-3-oxo-2-piperazinyl]-N-[(1-pyridin-4-yl-4-piperidinyl)methyl]acetamide IUPAC Name: 2-(1-naphthalen-2-ylsulfonyl-3-oxopiperazin-2-yl)-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]acetamide Traditional Name: 2-[3-keto-1-(2-naphthylsulfonyl)piperazin-2-yl]-N-[[1-(4-pyridyl)-4-piperidyl]methyl]acetamide Formula: C27H31N5O4S MolecularWeight: 521.63114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CNC(=O)CC2C(=O)NCCN2S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC=NC=C5

InChI

InChI=1S/C27H31N5O4S/c33-26(30-19-20-9-14-31(15-10-20)23-7-11-28-12-8-23)18-25-27(34)29-13-16-32(25)37(35,36)24-6-5-21-3-1-2-4-22(21)17-24/h1-8,11-12,17,20,25H,9-10,13-16,18-19H2,(H,29,34)(H,30,33)