5-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 5-[(3-chloro-4-methoxy-phenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(3-chloro-4-methoxyphenyl)methyl]-2-[(4-fluorophenyl)methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 5-[(3-chloro-4-methoxyphenyl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-(3-chloro-4-methoxy-benzyl)-2-[(4-fluorobenzyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C20H18ClFN2O2S MolecularWeight: 404.885523

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClFN2O2S/c1-12-16(9-14-5-8-18(26-2)17(21)10-14)19(25)24-20(23-12)27-11-13-3-6-15(22)7-4-13/h3-8,10H,9,11H2,1-2H3,(H,23,24,25)