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

Systemtic Name: N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[2-(m-tolylmethylsulfanyl)ethyl]-1-(m-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-N-[2-[(3-methylphenyl)methylthio]ethyl]-4-piperidinecarboxamide IUPAC Name: N-[2-[(3-methylphenyl)methylsulfanyl]ethyl]-1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(3-methylbenzyl)sulfonyl-N-[2-[(3-methylbenzyl)thio]ethyl]isonipecotamide Formula: C24H32N2O3S2 MolecularWeight: 460.65248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)CSCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C24H32N2O3S2/c1-19-5-3-7-21(15-19)17-30-14-11-25-24(27)23-9-12-26(13-10-23)31(28,29)18-22-8-4-6-20(2)16-22/h3-8,15-16,23H,9-14,17-18H2,1-2H3,(H,25,27)