methyl 2-[(4-methoxycarbonylphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 2-[(4-methoxycarbonylphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 2-[(4-methoxycarbonylbenzoyl)carbamothioylamino]benzoate CAS Name: 2-[[[[(4-methoxycarbonylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-methoxycarbonylbenzoyl)carbamothioylamino]benzoate Traditional Name: 2-[(4-carbomethoxybenzoyl)thiocarbamoylamino]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)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)OC

InChI

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