diethyl 2-[[(3-carbamothioyl-4-chloranyl-phenyl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(3-carbamothioyl-4-chloranyl-phenyl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[(3-carbamothioyl-4-chloro-anilino)methylene]propanedioate CAS Name: 2-[(3-carbamothioyl-4-chloroanilino)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-carbamothioyl-4-chloroanilino)methylidene]propanedioate Traditional Name: 2-[(4-chloro-3-thiocarbamoyl-anilino)methylene]malonic acid diethyl ester Formula: C15H17ClN2O4S MolecularWeight: 356.82448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1)Cl)C(=S)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC(=C(C=C1)Cl)C(=S)N)C(=O)OCC

InChI

InChI=1S/C15H17ClN2O4S/c1-3-21-14(19)11(15(20)22-4-2)8-18-9-5-6-12(16)10(7-9)13(17)23/h5-8,18H,3-4H2,1-2H3,(H2,17,23)