methyl 3-[(4-chlorophenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 3-[(4-chlorophenyl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 3-[(4-chlorobenzoyl)carbamothioylamino]benzoate CAS Name: 3-[[[[(4-chlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-chlorobenzoyl)carbamothioylamino]benzoate Traditional Name: 3-[(4-chlorobenzoyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2O3S/c1-22-15(21)11-3-2-4-13(9-11)18-16(23)19-14(20)10-5-7-12(17)8-6-10/h2-9H,1H3,(H2,18,19,20,23)