methyl 4-[(3,4,5-trimethoxyphenyl)carbamothioylamino]benzoate

Systemtic Name: methyl 4-[(3,4,5-trimethoxyphenyl)carbamothioylamino]benzoate Openeye Name: methyl 4-[(3,4,5-trimethoxyphenyl)carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3,4,5-trimethoxyphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,4,5-trimethoxyphenyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O5S/c1-22-14-9-13(10-15(23-2)16(14)24-3)20-18(26)19-12-7-5-11(6-8-12)17(21)25-4/h5-10H,1-4H3,(H2,19,20,26)