2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methylpyrimidin-5-yl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methylpyrimidin-5-yl)methyl]-1H-pyrimidin-6-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methylpyrimidin-5-yl)methyl]-1H-pyrimidin-6-one CAS Name: 2-[(4-fluorophenyl)methylthio]-5-[(2-methyl-5-pyrimidinyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(2-methylpyrimidin-5-yl)methyl]-1H-pyrimidin-6-one Traditional Name: 2-[(4-fluorobenzyl)thio]-5-[(2-methylpyrimidin-5-yl)methyl]-1H-pyrimidin-6-one Formula: C17H15FN4OS MolecularWeight: 342.390603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN4OS/c1-11-19-7-13(8-20-11)6-14-9-21-17(22-16(14)23)24-10-12-2-4-15(18)5-3-12/h2-5,7-9H,6,10H2,1H3,(H,21,22,23)