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

Systemtic Name: 5-[[2-(dimethylamino)pyrimidin-5-yl]methyl]-2-[(4-fluorophenyl)methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 5-[[2-(dimethylamino)pyrimidin-5-yl]methyl]-2-[(4-fluorophenyl)methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 5-[[2-(dimethylamino)-5-pyrimidinyl]methyl]-2-[(4-fluorophenyl)methylthio]-1H-pyrimidin-6-one IUPAC Name: 5-[[2-(dimethylamino)pyrimidin-5-yl]methyl]-2-[(4-fluorophenyl)methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 5-[[2-(dimethylamino)pyrimidin-5-yl]methyl]-2-[(4-fluorobenzyl)thio]-1H-pyrimidin-6-one Formula: C18H18FN5OS MolecularWeight: 371.431823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

Isomeric SMILES

CN(C)C1=NC=C(C=N1)CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN5OS/c1-24(2)17-20-8-13(9-21-17)7-14-10-22-18(23-16(14)25)26-11-12-3-5-15(19)6-4-12/h3-6,8-10H,7,11H2,1-2H3,(H,22,23,25)