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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-5-(2-methylpropyl)-1H-pyrimidin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-isobutyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-6-methyl-5-(2-methylpropyl)-1H-pyrimidin-4-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-5-(2-methylpropyl)-1H-pyrimidin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-5-isobutyl-6-methyl-1H-pyrimidin-4-one Formula: C16H19FN2OS MolecularWeight: 306.398263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC(C)C

InChI

InChI=1S/C16H19FN2OS/c1-10(2)8-14-11(3)18-16(19-15(14)20)21-9-12-4-6-13(17)7-5-12/h4-7,10H,8-9H2,1-3H3,(H,18,19,20)