methyl 3-[[2-(2-ethoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 3-[[2-(2-ethoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate Openeye Name: methyl 3-[[2-(2-ethoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate CAS Name: 3-[[[[2-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-ethoxyethoxy)phenyl]carbamothioylcarbamoyl]benzoate Traditional Name: 3-[[2-(2-ethoxyethoxy)phenyl]thiocarbamoylcarbamoyl]benzoic acid methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CCOCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O5S/c1-3-26-11-12-27-17-10-5-4-9-16(17)21-20(28)22-18(23)14-7-6-8-15(13-14)19(24)25-2/h4-10,13H,3,11-12H2,1-2H3,(H2,21,22,23,28)