(E)-2-(4-methylphenyl)sulfonyl-3-methylsulfanyl-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)sulfonyl-3-methylsulfanyl-3-phenylazanyl-prop-2-enenitrile Openeye Name: (E)-3-anilino-3-methylsulfanyl-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: (E)-3-anilino-2-(4-methylphenyl)sulfonyl-3-(methylthio)-2-propenenitrile IUPAC Name: (E)-3-anilino-2-(4-methylphenyl)sulfonyl-3-methylsulfanylprop-2-enenitrile Traditional Name: (E)-3-anilino-3-(methylthio)-2-tosyl-acrylonitrile Formula: C17H16N2O2S2 MolecularWeight: 344.45114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C(NC2=CC=CC=C2)SC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C(\NC2=CC=CC=C2)/SC)/C#N

InChI

InChI=1S/C17H16N2O2S2/c1-13-8-10-15(11-9-13)23(20,21)16(12-18)17(22-2)19-14-6-4-3-5-7-14/h3-11,19H,1-2H3/b17-16+