2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one CAS Name: 2-[(2-chloro-6-fluorophenyl)methylthio]-6-phenyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-phenyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]-6-phenyl-1H-pyrimidin-4-one Formula: C17H12ClFN2OS MolecularWeight: 346.806383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H12ClFN2OS/c18-13-7-4-8-14(19)12(13)10-23-17-20-15(9-16(22)21-17)11-5-2-1-3-6-11/h1-9H,10H2,(H,20,21,22)