methyl 4,5-dimethoxy-2-[(4-methylphenyl)methylcarbamothioylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(4-methylphenyl)methylcarbamothioylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-(p-tolylmethylcarbamothioylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(4-methylphenyl)methylcarbamothioylamino]benzoate Traditional Name: 4,5-dimethoxy-2-[(4-methylbenzyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C19H22N2O4S/c1-12-5-7-13(8-6-12)11-20-19(26)21-15-10-17(24-3)16(23-2)9-14(15)18(22)25-4/h5-10H,11H2,1-4H3,(H2,20,21,26)