ethyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1-fluoranyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1-fluoranyl-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1-fluoro-cyclohex-2-ene-1-carboxylate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-1-fluoro-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1-fluorocyclohex-2-ene-1-carboxylate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]-1-fluoro-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C15H19FN2O4S MolecularWeight: 342.385763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCC=C1SC2=NC(=CC(=N2)OC)OC)F

Isomeric SMILES

CCOC(=O)C1(CCCC=C1SC2=NC(=CC(=N2)OC)OC)F

InChI

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