N-[4-[5-(4-phenylsulfanylpiperidin-1-yl)pent-1-ynyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[5-(4-phenylsulfanylpiperidin-1-yl)pent-1-ynyl]phenyl]methanesulfonamide Openeye Name: N-[4-[5-(4-phenylsulfanyl-1-piperidyl)pent-1-ynyl]phenyl]methanesulfonamide CAS Name: N-[4-[5-[4-(phenylthio)-1-piperidinyl]pent-1-ynyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[5-(4-phenylsulfanylpiperidin-1-yl)pent-1-ynyl]phenyl]methanesulfonamide Traditional Name: N-[4-[5-[4-(phenylthio)piperidino]pent-1-ynyl]phenyl]methanesulfonamide Formula: C23H28N2O2S2 MolecularWeight: 428.61062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C#CCCCN2CCC(CC2)SC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C#CCCCN2CCC(CC2)SC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S2/c1-29(26,27)24-21-13-11-20(12-14-21)8-4-3-7-17-25-18-15-23(16-19-25)28-22-9-5-2-6-10-22/h2,5-6,9-14,23-24H,3,7,15-19H2,1H3