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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrimidin-6-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrimidin-6-one CAS Name: 2-[(4-fluorophenyl)methylthio]-5-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrimidin-6-one Traditional Name: 2-[(4-fluorobenzyl)thio]-5-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrimidin-6-one Formula: C16H15FN4OS MolecularWeight: 330.379903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNN=C1)C2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C1=CNN=C1)C2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN4OS/c1-10(12-6-19-20-7-12)14-8-18-16(21-15(14)22)23-9-11-2-4-13(17)5-3-11/h2-8,10H,9H2,1H3,(H,19,20)(H,18,21,22)