2-[(4E)-3-ethoxy-4-(phenylsulfonylmethylidene)pyridin-1-yl]propanedinitrile

Systemtic Name: 2-[(4E)-3-ethoxy-4-(phenylsulfonylmethylidene)pyridin-1-yl]propanedinitrile Openeye Name: 2-[(4E)-4-(benzenesulfonylmethylene)-3-ethoxy-1-pyridyl]propanedinitrile CAS Name: 2-[(4E)-4-(benzenesulfonylmethylidene)-3-ethoxy-1-pyridinyl]propanedinitrile IUPAC Name: 2-[(4E)-4-(benzenesulfonylmethylidene)-3-ethoxypyridin-1-yl]propanedinitrile Traditional Name: 2-[(4E)-4-(besylmethylene)-3-ethoxy-1-pyridyl]malononitrile Formula: C17H15N3O3S MolecularWeight: 341.3843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C=CC1=CS(=O)(=O)C2=CC=CC=C2)C(C#N)C#N

Isomeric SMILES

CCOC\1=CN(C=C/C1=C\S(=O)(=O)C2=CC=CC=C2)C(C#N)C#N

InChI

InChI=1S/C17H15N3O3S/c1-2-23-17-12-20(15(10-18)11-19)9-8-14(17)13-24(21,22)16-6-4-3-5-7-16/h3-9,12-13,15H,2H2,1H3/b14-13+