ethyl 4-(5-fluoranyl-4-methylsulfanyl-pyrimidin-2-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-fluoranyl-4-methylsulfanyl-pyrimidin-2-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(5-fluoro-4-methylsulfanyl-pyrimidin-2-yl)piperazine-1-carboxylate CAS Name: 4-[5-fluoro-4-(methylthio)-2-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-fluoro-4-methylsulfanylpyrimidin-2-yl)piperazine-1-carboxylate Traditional Name: 4-[5-fluoro-4-(methylthio)pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C12H17FN4O2S MolecularWeight: 300.352383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=C(C(=N2)SC)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=C(C(=N2)SC)F

InChI

InChI=1S/C12H17FN4O2S/c1-3-19-12(18)17-6-4-16(5-7-17)11-14-8-9(13)10(15-11)20-2/h8H,3-7H2,1-2H3