diethyl 2-[[(6-ethylsulfanyl-5-fluoranyl-pyridin-2-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(6-ethylsulfanyl-5-fluoranyl-pyridin-2-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[(6-ethylsulfanyl-5-fluoro-2-pyridyl)amino]methylene]propanedioate CAS Name: 2-[[[6-(ethylthio)-5-fluoro-2-pyridinyl]amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(6-ethylsulfanyl-5-fluoropyridin-2-yl)amino]methylidene]propanedioate Traditional Name: 2-[[[6-(ethylthio)-5-fluoro-2-pyridyl]amino]methylene]malonic acid diethyl ester Formula: C15H19FN2O4S MolecularWeight: 342.385763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=NC(=C(C=C1)F)SCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=NC(=C(C=C1)F)SCC)C(=O)OCC

InChI

InChI=1S/C15H19FN2O4S/c1-4-21-14(19)10(15(20)22-5-2)9-17-12-8-7-11(16)13(18-12)23-6-3/h7-9H,4-6H2,1-3H3,(H,17,18)