3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-one

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-methyl-2-(phenylmethylsulfanyl)pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3-[(2-chloro-6-fluoro-phenyl)methyl]-6-methyl-pyrimidin-4-one CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-2-(phenylmethylthio)-4-pyrimidinone IUPAC Name: 2-benzylsulfanyl-3-[(2-chloro-6-fluorophenyl)methyl]-6-methylpyrimidin-4-one Traditional Name: 2-(benzylthio)-3-(2-chloro-6-fluoro-benzyl)-6-methyl-pyrimidin-4-one Formula: C19H16ClFN2OS MolecularWeight: 374.859543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F

InChI

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