(4-azanyl-2-methylsulfanyl-pyrimidin-5-yl)-(5-fluoranyl-2-methoxy-phenyl)methanone

Systemtic Name: (4-azanyl-2-methylsulfanyl-pyrimidin-5-yl)-(5-fluoranyl-2-methoxy-phenyl)methanone Openeye Name: (4-amino-2-methylsulfanyl-pyrimidin-5-yl)-(5-fluoro-2-methoxy-phenyl)methanone CAS Name: [4-amino-2-(methylthio)-5-pyrimidinyl]-(5-fluoro-2-methoxyphenyl)methanone IUPAC Name: (4-amino-2-methylsulfanylpyrimidin-5-yl)-(5-fluoro-2-methoxyphenyl)methanone Traditional Name: [4-amino-2-(methylthio)pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)methanone Formula: C13H12FN3O2S MolecularWeight: 293.316683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)SC

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)SC

InChI

InChI=1S/C13H12FN3O2S/c1-19-10-4-3-7(14)5-8(10)11(18)9-6-16-13(20-2)17-12(9)15/h3-6H,1-2H3,(H2,15,16,17)