diethyl 5-[(2-chlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(2-chlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(2-chlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[(2-chloroanilino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(2-chlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-chlorophenyl)thiocarbamoylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC=CC=C2Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC=CC=C2Cl)C(=O)OCC

InChI

InChI=1S/C19H19ClN2O4S/c1-3-25-17(23)12-9-13(18(24)26-4-2)11-14(10-12)21-19(27)22-16-8-6-5-7-15(16)20/h5-11H,3-4H2,1-2H3,(H2,21,22,27)