N-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-(2-methylpentan-2-ylsulfanyl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[4-(1,1-dimethylbutylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[4-(2-methylpentan-2-ylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[4-(2-methylpentan-2-ylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[4-(1,1-dimethylbutylthio)phenyl]isonipecotamide Formula: C24H32N2O3S2 MolecularWeight: 460.65248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)(C)SC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3S2/c1-4-16-24(2,3)30-21-12-10-20(11-13-21)25-23(27)19-14-17-26(18-15-19)31(28,29)22-8-6-5-7-9-22/h5-13,19H,4,14-18H2,1-3H3,(H,25,27)