1-methylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[2-(3-thienylmethylsulfanyl)phenyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[2-(3-thiophenylmethylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[2-(3-thenylthio)phenyl]isonipecotamide Formula: C18H22N2O3S3 MolecularWeight: 410.57388

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2SCC3=CSC=C3

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC=C2SCC3=CSC=C3

InChI

InChI=1S/C18H22N2O3S3/c1-26(22,23)20-9-6-15(7-10-20)18(21)19-16-4-2-3-5-17(16)25-13-14-8-11-24-12-14/h2-5,8,11-12,15H,6-7,9-10,13H2,1H3,(H,19,21)