(E)-3-[(4-chlorophenyl)amino]-3-(4-methylphenyl)-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[(4-chlorophenyl)amino]-3-(4-methylphenyl)-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-(4-chloroanilino)-2-methylsulfonyl-3-(p-tolyl)prop-2-enenitrile CAS Name: (E)-3-(4-chloroanilino)-3-(4-methylphenyl)-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-(4-chloroanilino)-3-(4-methylphenyl)-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-(4-chloroanilino)-2-mesyl-3-(p-tolyl)acrylonitrile Formula: C17H15ClN2O2S MolecularWeight: 346.8312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15ClN2O2S/c1-12-3-5-13(6-4-12)17(16(11-19)23(2,21)22)20-15-9-7-14(18)8-10-15/h3-10,20H,1-2H3/b17-16+