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

Systemtic Name: diethyl 2-[[(3-chloranyl-4-fluoranyl-phenyl)amino]-ethylsulfanyl-methylidene]propanedioate Openeye Name: diethyl 2-[(3-chloro-4-fluoro-anilino)-ethylsulfanyl-methylene]propanedioate CAS Name: 2-[(3-chloro-4-fluoroanilino)-(ethylthio)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-chloro-4-fluoroanilino)-ethylsulfanylmethylidene]propanedioate Traditional Name: 2-[(3-chloro-4-fluoro-anilino)-(ethylthio)methylene]malonic acid diethyl ester Formula: C16H19ClFNO4S MolecularWeight: 375.842763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CC(=C(C=C1)F)Cl)SCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C(NC1=CC(=C(C=C1)F)Cl)SCC)C(=O)OCC

InChI

InChI=1S/C16H19ClFNO4S/c1-4-22-15(20)13(16(21)23-5-2)14(24-6-3)19-10-7-8-12(18)11(17)9-10/h7-9,19H,4-6H2,1-3H3