N-[(Z)-3-cyano-2-(4-methylphenyl)sulfanyl-prop-2-enyl]-4-methyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: N-[(Z)-3-cyano-2-(4-methylphenyl)sulfanyl-prop-2-enyl]-4-methyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-N-[(Z)-3-cyano-2-(p-tolylsulfanyl)allyl]-4-methyl-benzenesulfonamide CAS Name: N-[(Z)-3-cyano-2-[(4-methylphenyl)thio]prop-2-enyl]-4-methyl-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-[(Z)-3-cyano-2-(4-methylphenyl)sulfanylprop-2-enyl]-4-methyl-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-N-[(Z)-3-cyano-2-(p-tolylthio)allyl]-4-methyl-benzenesulfonamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=CC#N)CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S/C(=C\C#N)/CN(CC=C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H22N2O2S2/c1-4-15-23(27(24,25)21-11-7-18(3)8-12-21)16-20(13-14-22)26-19-9-5-17(2)6-10-19/h4-13H,1,15-16H2,2-3H3/b20-13-