4-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-methylsulfanyl-N-[[4-(1-piperidylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-(methylthio)-N-[[4-(1-piperidinylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-methylsulfanyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-(methylthio)-N-[4-(piperidinomethyl)benzyl]benzenesulfonamide Formula: C20H26N2O2S2 MolecularWeight: 390.56264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3CCCCC3

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3CCCCC3

InChI

InChI=1S/C20H26N2O2S2/c1-25-19-9-11-20(12-10-19)26(23,24)21-15-17-5-7-18(8-6-17)16-22-13-3-2-4-14-22/h5-12,21H,2-4,13-16H2,1H3