1-(4-methylsulfanylphenyl)sulfonyl-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-methylsulfanylphenyl)sulfonyl-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide Openeye Name: N-(4-benzyloxyphenyl)-1-(4-methylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-[4-(methylthio)phenyl]sulfonyl-N-(4-phenylmethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylsulfanylphenyl)sulfonyl-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide Traditional Name: N-(4-benzoxyphenyl)-1-[4-(methylthio)phenyl]sulfonyl-isonipecotamide Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4S2/c1-33-24-11-13-25(14-12-24)34(30,31)28-17-15-21(16-18-28)26(29)27-22-7-9-23(10-8-22)32-19-20-5-3-2-4-6-20/h2-14,21H,15-19H2,1H3,(H,27,29)