1-[(4-fluorophenyl)methylsulfanyl]-3-methyl-2-[(1-methylpyrazol-4-yl)methyl]-1,3-diazinan-5-one

Systemtic Name: 1-[(4-fluorophenyl)methylsulfanyl]-3-methyl-2-[(1-methylpyrazol-4-yl)methyl]-1,3-diazinan-5-one Openeye Name: 1-[(4-fluorophenyl)methylsulfanyl]-3-methyl-2-[(1-methylpyrazol-4-yl)methyl]hexahydropyrimidin-5-one CAS Name: 1-[(4-fluorophenyl)methylthio]-3-methyl-2-[(1-methyl-4-pyrazolyl)methyl]-1,3-diazinan-5-one IUPAC Name: 1-[(4-fluorophenyl)methylsulfanyl]-3-methyl-2-[(1-methylpyrazol-4-yl)methyl]-1,3-diazinan-5-one Traditional Name: 1-[(4-fluorobenzyl)thio]-3-methyl-2-[(1-methylpyrazol-4-yl)methyl]hexahydropyrimidin-5-one Formula: C17H21FN4OS MolecularWeight: 348.438243

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)CN(C1CC2=CN(N=C2)C)SCC3=CC=C(C=C3)F

Isomeric SMILES

CN1CC(=O)CN(C1CC2=CN(N=C2)C)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H21FN4OS/c1-20-10-16(23)11-22(17(20)7-14-8-19-21(2)9-14)24-12-13-3-5-15(18)6-4-13/h3-6,8-9,17H,7,10-12H2,1-2H3