ethyl 4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(2,6-dimethoxybenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C19H20N2O5S/c1-4-26-18(23)12-8-10-13(11-9-12)20-19(27)21-17(22)16-14(24-2)6-5-7-15(16)25-3/h5-11H,4H2,1-3H3,(H2,20,21,22,27)