4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-phenyl-1H-1,3,5-triazin-2-one

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-6-phenyl-1H-1,3,5-triazin-2-one Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-6-phenyl-1H-1,3,5-triazin-2-one CAS Name: 4-[(2-chloro-6-fluorophenyl)methylthio]-6-phenyl-1H-1,3,5-triazin-2-one IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methylsulfanyl]-6-phenyl-1H-1,3,5-triazin-2-one Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)thio]-6-phenyl-1H-s-triazin-2-one Formula: C16H11ClFN3OS MolecularWeight: 347.794443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClFN3OS/c17-12-7-4-8-13(18)11(12)9-23-16-20-14(19-15(22)21-16)10-5-2-1-3-6-10/h1-8H,9H2,(H,19,20,21,22)