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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-6-methyl-5-p-anisyl-1H-pyrimidin-4-one Formula: C20H19FN2O2S MolecularWeight: 370.440463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=C(C=C2)F)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19FN2O2S/c1-13-18(11-14-5-9-17(25-2)10-6-14)19(24)23-20(22-13)26-12-15-3-7-16(21)8-4-15/h3-10H,11-12H2,1-2H3,(H,22,23,24)