diethyl 2-[[(3,4-dichlorophenyl)carbamothioylamino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(3,4-dichlorophenyl)carbamothioylamino]methylidene]propanedioate Openeye Name: diethyl 2-[[(3,4-dichlorophenyl)carbamothioylamino]methylene]propanedioate CAS Name: 2-[[[(3,4-dichloroanilino)-sulfanylidenemethyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(3,4-dichlorophenyl)carbamothioylamino]methylidene]propanedioate Traditional Name: 2-[[(3,4-dichlorophenyl)thiocarbamoylamino]methylene]malonic acid diethyl ester Formula: C15H16Cl2N2O4S MolecularWeight: 391.26954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(=S)NC1=CC(=C(C=C1)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC(=S)NC1=CC(=C(C=C1)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C15H16Cl2N2O4S/c1-3-22-13(20)10(14(21)23-4-2)8-18-15(24)19-9-5-6-11(16)12(17)7-9/h5-8H,3-4H2,1-2H3,(H2,18,19,24)