2-(4-methylphenyl)-2-[(4-methylsulfonylphenyl)amino]ethanenitrile

Systemtic Name: 2-(4-methylphenyl)-2-[(4-methylsulfonylphenyl)amino]ethanenitrile Openeye Name: 2-(4-methylsulfonylanilino)-2-(p-tolyl)acetonitrile CAS Name: 2-(4-methylphenyl)-2-(4-methylsulfonylanilino)acetonitrile IUPAC Name: 2-(4-methylphenyl)-2-(4-methylsulfonylanilino)acetonitrile Traditional Name: 2-(4-mesylanilino)-2-(p-tolyl)acetonitrile Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O2S/c1-12-3-5-13(6-4-12)16(11-17)18-14-7-9-15(10-8-14)21(2,19)20/h3-10,16,18H,1-2H3