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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[[1-(2-methoxyethyl)pyrazol-4-yl]methyl]-1H-pyrimidin-6-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[[1-(2-methoxyethyl)pyrazol-4-yl]methyl]-1H-pyrimidin-6-one CAS Name: 2-[(4-fluorophenyl)methylthio]-5-[[1-(2-methoxyethyl)-4-pyrazolyl]methyl]-1H-pyrimidin-6-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[[1-(2-methoxyethyl)pyrazol-4-yl]methyl]-1H-pyrimidin-6-one Traditional Name: 2-[(4-fluorobenzyl)thio]-5-[[1-(2-methoxyethyl)pyrazol-4-yl]methyl]-1H-pyrimidin-6-one Formula: C18H19FN4O2S MolecularWeight: 374.432463

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

Isomeric SMILES

COCCN1C=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN4O2S/c1-25-7-6-23-11-14(9-21-23)8-15-10-20-18(22-17(15)24)26-12-13-2-4-16(19)5-3-13/h2-5,9-11H,6-8,12H2,1H3,(H,20,22,24)