1-(2-cyanophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(2-thienylmethylsulfanyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(2-thenylthio)ethyl]isonipecotamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCSCC2=CC=CS2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCC1C(=O)NCCSCC2=CC=CS2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H23N3O3S3/c21-14-17-4-1-2-6-19(17)29(25,26)23-10-7-16(8-11-23)20(24)22-9-13-27-15-18-5-3-12-28-18/h1-6,12,16H,7-11,13,15H2,(H,22,24)