3-[1-(4-methylsulfonylphenyl)ethylamino]benzenecarbonitrile

Systemtic Name: 3-[1-(4-methylsulfonylphenyl)ethylamino]benzenecarbonitrile Openeye Name: 3-[1-(4-methylsulfonylphenyl)ethylamino]benzonitrile CAS Name: 3-[1-(4-methylsulfonylphenyl)ethylamino]benzonitrile IUPAC Name: 3-[1-(4-methylsulfonylphenyl)ethylamino]benzonitrile Traditional Name: 3-[1-(4-mesylphenyl)ethylamino]benzonitrile Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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