dimethyl 5-(cyclopropylcarbonylcarbamothioylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(cyclopropylcarbonylcarbamothioylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(cyclopropanecarbonylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[[[cyclopropyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(cyclopropanecarbonylcarbamothioylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(cyclopropanecarbonylthiocarbamoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C2CC2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=S)NC(=O)C2CC2)C(=O)OC

InChI

InChI=1S/C15H16N2O5S/c1-21-13(19)9-5-10(14(20)22-2)7-11(6-9)16-15(23)17-12(18)8-3-4-8/h5-8H,3-4H2,1-2H3,(H2,16,17,18,23)