methyl 3-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-1,3-thiazol-2-yl]sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[(5E)-5-(1,3-benzodioxol-5-ylmethylene)-4-oxo-thiazol-2-yl]sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thiazolyl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-1,3-thiazol-2-yl]sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[(5E)-4-keto-5-piperonylidene-2-thiazolin-2-yl]sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C17H12N2O7S3 MolecularWeight: 452.48138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=NC(=O)C(=CC3=CC4=C(C=C3)OCO4)S2

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=NC(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/S2

InChI

InChI=1S/C17H12N2O7S3/c1-24-16(21)14-13(4-5-27-14)29(22,23)19-17-18-15(20)12(28-17)7-9-2-3-10-11(6-9)26-8-25-10/h2-7H,8H2,1H3,(H,18,19,20)/b12-7+