4-methyl-N-[(E)-3-phenylsulfanylprop-2-enyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(E)-3-phenylsulfanylprop-2-enyl]benzenesulfonamide Openeye Name: 4-methyl-N-[(E)-3-phenylsulfanylallyl]benzenesulfonamide CAS Name: 4-methyl-N-[(E)-3-(phenylthio)prop-2-enyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(E)-3-phenylsulfanylprop-2-enyl]benzenesulfonamide Traditional Name: 4-methyl-N-[(E)-3-(phenylthio)allyl]benzenesulfonamide Formula: C16H17NO2S2 MolecularWeight: 319.44168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC=CSC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC/C=C/SC2=CC=CC=C2

InChI

InChI=1S/C16H17NO2S2/c1-14-8-10-16(11-9-14)21(18,19)17-12-5-13-20-15-6-3-2-4-7-15/h2-11,13,17H,12H2,1H3/b13-5+