4-methylsulfanyl-N-[3-(2-pyridin-2-ylethyl)phenyl]benzenesulfonamide

Systemtic Name: 4-methylsulfanyl-N-[3-(2-pyridin-2-ylethyl)phenyl]benzenesulfonamide Openeye Name: 4-methylsulfanyl-N-[3-[2-(2-pyridyl)ethyl]phenyl]benzenesulfonamide CAS Name: 4-(methylthio)-N-[3-[2-(2-pyridinyl)ethyl]phenyl]benzenesulfonamide IUPAC Name: 4-methylsulfanyl-N-[3-(2-pyridin-2-ylethyl)phenyl]benzenesulfonamide Traditional Name: 4-(methylthio)-N-[3-[2-(2-pyridyl)ethyl]phenyl]benzenesulfonamide Formula: C20H20N2O2S2 MolecularWeight: 384.515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCC3=CC=CC=N3

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCC3=CC=CC=N3

InChI

InChI=1S/C20H20N2O2S2/c1-25-19-10-12-20(13-11-19)26(23,24)22-18-7-4-5-16(15-18)8-9-17-6-2-3-14-21-17/h2-7,10-15,22H,8-9H2,1H3