1-(4-chlorophenyl)sulfonyl-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-[2-(phenylmethylsulfanyl)ethyl]piperidine-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(4-chlorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[2-(phenylmethylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-(4-chlorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(4-chlorophenyl)sulfonyl-isonipecotamide Formula: C21H25ClN2O3S2 MolecularWeight: 453.0178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O3S2/c22-19-6-8-20(9-7-19)29(26,27)24-13-10-18(11-14-24)21(25)23-12-15-28-16-17-4-2-1-3-5-17/h1-9,18H,10-16H2,(H,23,25)