dimethyl 5-(furan-2-ylcarbonylcarbamothioylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(furan-2-ylcarbonylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(furan-2-carbonylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(furan-2-carbonylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(2-furoylthiocarbamoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H14N2O6S MolecularWeight: 362.35716

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CO2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=CO2)C(=O)OC

InChI

InChI=1S/C16H14N2O6S/c1-22-14(20)9-6-10(15(21)23-2)8-11(7-9)17-16(25)18-13(19)12-4-3-5-24-12/h3-8H,1-2H3,(H2,17,18,19,25)