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

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-2H-1,2,4-triazin-5-one Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-2H-1,2,4-triazin-5-one Formula: C10H7ClFN3OS MolecularWeight: 271.698483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NC(=O)C=NN2)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NC(=O)C=NN2)F

InChI

InChI=1S/C10H7ClFN3OS/c11-7-2-1-3-8(12)6(7)5-17-10-14-9(16)4-13-15-10/h1-4H,5H2,(H,14,15,16)