N-(4-cyclopentylsulfanylphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(cyclopentylthio)phenyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-1-tosyl-isonipecotamide Formula: C24H30N2O3S2 MolecularWeight: 458.6366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)SC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)SC4CCCC4

InChI

InChI=1S/C24H30N2O3S2/c1-18-6-12-23(13-7-18)31(28,29)26-16-14-19(15-17-26)24(27)25-20-8-10-22(11-9-20)30-21-4-2-3-5-21/h6-13,19,21H,2-5,14-17H2,1H3,(H,25,27)