1-(4-methoxyphenyl)sulfonyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-(m-tolylmethylsulfanyl)ethyl]piperidine-3-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-[(3-methylphenyl)methylthio]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]piperidine-3-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-[(3-methylbenzyl)thio]ethyl]nipecotamide Formula: C23H30N2O4S2 MolecularWeight: 462.6253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=CC=C1)CSCCNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H30N2O4S2/c1-18-5-3-6-19(15-18)17-30-14-12-24-23(26)20-7-4-13-25(16-20)31(27,28)22-10-8-21(29-2)9-11-22/h3,5-6,8-11,15,20H,4,7,12-14,16-17H2,1-2H3,(H,24,26)