methyl 4-(2-phenoxyethanoylcarbamothioylamino)benzoate

Systemtic Name: methyl 4-(2-phenoxyethanoylcarbamothioylamino)benzoate Openeye Name: methyl 4-[(2-phenoxyacetyl)carbamothioylamino]benzoate CAS Name: 4-[[[(1-oxo-2-phenoxyethyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-phenoxyacetyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-phenoxyacetyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C17H16N2O4S/c1-22-16(21)12-7-9-13(10-8-12)18-17(24)19-15(20)11-23-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,18,19,20,24)