N-(2-cyclopentylsulfanylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(cyclopentylthio)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H26N2O3S3 MolecularWeight: 450.63774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H26N2O3S3/c24-21(22-18-8-3-4-9-19(18)28-17-6-1-2-7-17)16-11-13-23(14-12-16)29(25,26)20-10-5-15-27-20/h3-5,8-10,15-17H,1-2,6-7,11-14H2,(H,22,24)