N-[2,6-di(propan-2-yl)phenyl]-2-[6-(4-pyridin-2-ylpiperazin-1-yl)hexylsulfanyl]ethanamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-2-[6-(4-pyridin-2-ylpiperazin-1-yl)hexylsulfanyl]ethanamide Openeye Name: N-(2,6-diisopropylphenyl)-2-[6-[4-(2-pyridyl)piperazin-1-yl]hexylsulfanyl]acetamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-2-[6-[4-(2-pyridinyl)-1-piperazinyl]hexylthio]acetamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-2-[6-(4-pyridin-2-ylpiperazin-1-yl)hexylsulfanyl]acetamide Traditional Name: N-(2,6-diisopropylphenyl)-2-[6-[4-(2-pyridyl)piperazino]hexylthio]acetamide Formula: C29H44N4OS MolecularWeight: 496.75086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSCCCCCCN2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CSCCCCCCN2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C29H44N4OS/c1-23(2)25-12-11-13-26(24(3)4)29(25)31-28(34)22-35-21-10-6-5-9-16-32-17-19-33(20-18-32)27-14-7-8-15-30-27/h7-8,11-15,23-24H,5-6,9-10,16-22H2,1-4H3,(H,31,34)