methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate Openeye Name: methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate CAS Name: 4-[[[[4-(2-methoxyethoxy)anilino]-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate Traditional Name: 4-[[4-(2-methoxyethoxy)phenyl]thiocarbamoylcarbamoyl]benzoic acid methyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H20N2O5S/c1-24-11-12-26-16-9-7-15(8-10-16)20-19(27)21-17(22)13-3-5-14(6-4-13)18(23)25-2/h3-10H,11-12H2,1-2H3,(H2,20,21,22,27)