diethyl 5-[[3,5-bis(chloranyl)phenyl]carbamothioylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[[3,5-bis(chloranyl)phenyl]carbamothioylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(3,5-dichlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[(3,5-dichloroanilino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(3,5-dichlorophenyl)carbamothioylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[(3,5-dichlorophenyl)thiocarbamoylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C19H18Cl2N2O4S MolecularWeight: 441.32822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=S)NC2=CC(=CC(=C2)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C19H18Cl2N2O4S/c1-3-26-17(24)11-5-12(18(25)27-4-2)7-15(6-11)22-19(28)23-16-9-13(20)8-14(21)10-16/h5-10H,3-4H2,1-2H3,(H2,22,23,28)