diethyl 2-(benzenecarbonothioylamino)propanedioate

Systemtic Name: diethyl 2-(benzenecarbonothioylamino)propanedioate Openeye Name: diethyl 2-(benzenecarbonothioylamino)propanedioate CAS Name: 2-(benzenecarbonothioylamino)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(benzenecarbonothioylamino)propanedioate Traditional Name: 2-(benzenecarbonothioylamino)malonic acid diethyl ester Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4S/c1-3-18-13(16)11(14(17)19-4-2)15-12(20)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3,(H,15,20)