ethyl (4-cyano-5-phenyl-1,2-thiazol-3-yl)sulfanylmethanoate

Systemtic Name: ethyl (4-cyano-5-phenyl-1,2-thiazol-3-yl)sulfanylmethanoate Openeye Name: ethyl (4-cyano-5-phenyl-isothiazol-3-yl)sulfanylformate CAS Name: [(4-cyano-5-phenyl-3-isothiazolyl)thio]formic acid ethyl ester IUPAC Name: ethyl (4-cyano-5-phenyl-1,2-thiazol-3-yl)sulfanylformate Traditional Name: [(4-cyano-5-phenyl-isothiazol-3-yl)thio]formic acid ethyl ester Formula: C13H10N2O2S2 MolecularWeight: 290.3607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)SC1=NSC(=C1C#N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)SC1=NSC(=C1C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H10N2O2S2/c1-2-17-13(16)18-12-10(8-14)11(19-15-12)9-6-4-3-5-7-9/h3-7H,2H2,1H3