N-(2-cyclopentylsulfanylphenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[2-(cyclopentylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2-cyclopentylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: 1-besyl-N-[2-(cyclopentylthio)phenyl]isonipecotamide Formula: C23H28N2O3S2 MolecularWeight: 444.61002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O3S2/c26-23(24-21-12-6-7-13-22(21)29-19-8-4-5-9-19)18-14-16-25(17-15-18)30(27,28)20-10-2-1-3-11-20/h1-3,6-7,10-13,18-19H,4-5,8-9,14-17H2,(H,24,26)