3-[(4-methylsulfonylphenyl)amino]propanenitrile

Systemtic Name: 3-[(4-methylsulfonylphenyl)amino]propanenitrile Openeye Name: 3-(4-methylsulfonylanilino)propanenitrile CAS Name: 3-(4-methylsulfonylanilino)propanenitrile IUPAC Name: 3-(4-methylsulfonylanilino)propanenitrile Traditional Name: 3-(4-mesylanilino)propionitrile Formula: C10H12N2O2S MolecularWeight: 224.27948

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NCCC#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NCCC#N

InChI

InChI=1S/C10H12N2O2S/c1-15(13,14)10-5-3-9(4-6-10)12-8-2-7-11/h3-6,12H,2,8H2,1H3