2-[(2-azanyl-4-methylsulfonyl-phenyl)-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[(2-azanyl-4-methylsulfonyl-phenyl)-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[2-amino-N-(cyanomethyl)-4-methylsulfonyl-anilino]acetonitrile CAS Name: 2-[2-amino-N-(cyanomethyl)-4-methylsulfonylanilino]acetonitrile IUPAC Name: 2-[2-amino-N-(cyanomethyl)-4-methylsulfonylanilino]acetonitrile Traditional Name: 2-[2-amino-N-(cyanomethyl)-4-mesyl-anilino]acetonitrile Formula: C11H12N4O2S MolecularWeight: 264.30358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N4O2S/c1-18(16,17)9-2-3-11(10(14)8-9)15(6-4-12)7-5-13/h2-3,8H,6-7,14H2,1H3