2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-pyrimidin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-pyrimidin-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methyl-pyrimidin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-methyl-4-pyrimidinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-methylpyrimidin-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-3-methyl-pyrimidin-4-one Formula: C12H11FN2OS MolecularWeight: 250.291943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CN=C1SCC2=CC(=CC=C2)F

Isomeric SMILES

CN1C(=O)C=CN=C1SCC2=CC(=CC=C2)F

InChI

InChI=1S/C12H11FN2OS/c1-15-11(16)5-6-14-12(15)17-8-9-3-2-4-10(13)7-9/h2-7H,8H2,1H3