methyl 3-(methylcarbamothioylcarbamoyl)benzoate

Systemtic Name: methyl 3-(methylcarbamothioylcarbamoyl)benzoate Openeye Name: methyl 3-(methylcarbamothioylcarbamoyl)benzoate CAS Name: 3-[[[methylamino(sulfanylidene)methyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(methylcarbamothioylcarbamoyl)benzoate Traditional Name: 3-(methylthiocarbamoylcarbamoyl)benzoic acid methyl ester Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC(=O)C1=CC(=CC=C1)C(=O)OC

Isomeric SMILES

CNC(=S)NC(=O)C1=CC(=CC=C1)C(=O)OC

InChI

InChI=1S/C11H12N2O3S/c1-12-11(17)13-9(14)7-4-3-5-8(6-7)10(15)16-2/h3-6H,1-2H3,(H2,12,13,14,17)