methyl 2-oxidanyl-4-(phenylcarbonylcarbamothioylamino)benzoate

Systemtic Name: methyl 2-oxidanyl-4-(phenylcarbonylcarbamothioylamino)benzoate Openeye Name: methyl 4-(benzoylcarbamothioylamino)-2-hydroxy-benzoate CAS Name: 4-[[benzamido(sulfanylidene)methyl]amino]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-(benzoylcarbamothioylamino)-2-hydroxybenzoate Traditional Name: 4-(benzoylthiocarbamoylamino)-2-hydroxy-benzoic acid methyl ester Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O4S/c1-22-15(21)12-8-7-11(9-13(12)19)17-16(23)18-14(20)10-5-3-2-4-6-10/h2-9,19H,1H3,(H2,17,18,20,23)