dimethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[(2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[(2,5-dimethoxyphenyl)thiocarbamoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H20N2O6S/c1-24-12-6-8-16(25-2)15(10-12)21-19(28)20-14-9-11(17(22)26-3)5-7-13(14)18(23)27-4/h5-10H,1-4H3,(H2,20,21,28)