methyl 3-[[(3-methoxycarbonylphenyl)methylcarbamothioylamino]methyl]benzoate

Systemtic Name: methyl 3-[[(3-methoxycarbonylphenyl)methylcarbamothioylamino]methyl]benzoate Openeye Name: methyl 3-[[(3-methoxycarbonylphenyl)methylcarbamothioylamino]methyl]benzoate CAS Name: 3-[[[[(3-methoxycarbonylphenyl)methylamino]-sulfanylidenemethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(3-methoxycarbonylphenyl)methylcarbamothioylamino]methyl]benzoate Traditional Name: 3-[[(3-carbomethoxybenzyl)thiocarbamoylamino]methyl]benzoic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CNC(=S)NCC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CNC(=S)NCC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C19H20N2O4S/c1-24-17(22)15-7-3-5-13(9-15)11-20-19(26)21-12-14-6-4-8-16(10-14)18(23)25-2/h3-10H,11-12H2,1-2H3,(H2,20,21,26)