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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(4-chlorobenzyl)thio]-5-(4-fluorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C19H16ClFN2OS MolecularWeight: 374.859543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClFN2OS/c1-12-17(10-13-4-8-16(21)9-5-13)18(24)23-19(22-12)25-11-14-2-6-15(20)7-3-14/h2-9H,10-11H2,1H3,(H,22,23,24)