[(Z)-[cyano(thiophen-2-yl)methylidene]amino] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-[cyano(thiophen-2-yl)methylidene]amino] 4-methylbenzenesulfonate Openeye Name: [(Z)-[cyano(2-thienyl)methylene]amino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-[cyano(thiophen-2-yl)methylidene]amino] ester IUPAC Name: [(Z)-[cyano(thiophen-2-yl)methylidene]amino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-[cyano(2-thienyl)methylene]amino] ester Formula: C13H10N2O3S2 MolecularWeight: 306.3601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON=C(C#N)C2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/N=C(/C#N)\C2=CC=CS2

InChI

InChI=1S/C13H10N2O3S2/c1-10-4-6-11(7-5-10)20(16,17)18-15-12(9-14)13-3-2-8-19-13/h2-8H,1H3/b15-12-