diethyl 2-[(3-chlorophenyl)carbonylcarbamothioylamino]propanedioate

Systemtic Name: diethyl 2-[(3-chlorophenyl)carbonylcarbamothioylamino]propanedioate Openeye Name: diethyl 2-[(3-chlorobenzoyl)carbamothioylamino]propanedioate CAS Name: 2-[[[[(3-chlorophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-chlorobenzoyl)carbamothioylamino]propanedioate Traditional Name: 2-[(3-chlorobenzoyl)thiocarbamoylamino]malonic acid diethyl ester Formula: C15H17ClN2O5S MolecularWeight: 372.82388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O5S/c1-3-22-13(20)11(14(21)23-4-2)17-15(24)18-12(19)9-6-5-7-10(16)8-9/h5-8,11H,3-4H2,1-2H3,(H2,17,18,19,24)