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

Systemtic Name: ethyl 1-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-fluoranyl-cyclohexane-1-carboxylate Openeye Name: ethyl 1-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-fluoro-cyclohexanecarboxylate CAS Name: 1-[(4,6-dimethoxy-2-pyrimidinyl)thio]-2-fluoro-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-2-fluorocyclohexane-1-carboxylate Traditional Name: 1-[(4,6-dimethoxypyrimidin-2-yl)thio]-2-fluoro-cyclohexanecarboxylic acid ethyl ester Formula: C15H21FN2O4S MolecularWeight: 344.401643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1F)SC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CCOC(=O)C1(CCCCC1F)SC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C15H21FN2O4S/c1-4-22-13(19)15(8-6-5-7-10(15)16)23-14-17-11(20-2)9-12(18-14)21-3/h9-10H,4-8H2,1-3H3