methyl 4-(2,5-dimethoxyphenyl)carbonyl-1,2,5-thiadiazole-3-carboxylate

Systemtic Name: methyl 4-(2,5-dimethoxyphenyl)carbonyl-1,2,5-thiadiazole-3-carboxylate Openeye Name: methyl 4-(2,5-dimethoxybenzoyl)-1,2,5-thiadiazole-3-carboxylate CAS Name: 4-[(2,5-dimethoxyphenyl)-oxomethyl]-1,2,5-thiadiazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethoxybenzoyl)-1,2,5-thiadiazole-3-carboxylate Traditional Name: 4-(2,5-dimethoxybenzoyl)-1,2,5-thiadiazole-3-carboxylic acid methyl ester Formula: C13H12N2O5S MolecularWeight: 308.30978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C2=NSN=C2C(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C2=NSN=C2C(=O)OC

InChI

InChI=1S/C13H12N2O5S/c1-18-7-4-5-9(19-2)8(6-7)12(16)10-11(13(17)20-3)15-21-14-10/h4-6H,1-3H3