methyl 2-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 2-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 2-[(3,4-dimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 2-[[[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3,4-dimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 2-(veratroylthiocarbamoylamino)benzoic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC)OC

InChI

InChI=1S/C18H18N2O5S/c1-23-14-9-8-11(10-15(14)24-2)16(21)20-18(26)19-13-7-5-4-6-12(13)17(22)25-3/h4-10H,1-3H3,(H2,19,20,21,26)