4-methoxy-N-[[1-(2-phenylsulfanylethanoyl)piperidin-3-yl]methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[[1-(2-phenylsulfanylethanoyl)piperidin-3-yl]methyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[[1-(2-phenylsulfanylacetyl)-3-piperidyl]methyl]benzenesulfonamide CAS Name: 4-methoxy-N-[[1-[1-oxo-2-(phenylthio)ethyl]-3-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[[1-(2-phenylsulfanylacetyl)piperidin-3-yl]methyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[[1-[2-(phenylthio)acetyl]-3-piperidyl]methyl]benzenesulfonamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S2/c1-27-18-9-11-20(12-10-18)29(25,26)22-14-17-6-5-13-23(15-17)21(24)16-28-19-7-3-2-4-8-19/h2-4,7-12,17,22H,5-6,13-16H2,1H3