methyl 3-[(4-methoxycarbonylphenyl)carbamothioylcarbamoyl]benzoate

Systemtic Name: methyl 3-[(4-methoxycarbonylphenyl)carbamothioylcarbamoyl]benzoate Openeye Name: methyl 3-[(4-methoxycarbonylphenyl)carbamothioylcarbamoyl]benzoate CAS Name: 3-[[[(4-methoxycarbonylanilino)-sulfanylidenemethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxycarbonylphenyl)carbamothioylcarbamoyl]benzoate Traditional Name: 3-[(4-carbomethoxyphenyl)thiocarbamoylcarbamoyl]benzoic acid methyl ester Formula: C18H16N2O5S MolecularWeight: 372.39504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O5S/c1-24-16(22)11-6-8-14(9-7-11)19-18(26)20-15(21)12-4-3-5-13(10-12)17(23)25-2/h3-10H,1-2H3,(H2,19,20,21,26)