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

Systemtic Name: 6-methyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-2H-1,2,4-triazin-5-one Openeye Name: 6-methyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-2H-1,2,4-triazin-5-one CAS Name: 6-methyl-3-[[4-(trifluoromethyl)phenyl]methylthio]-2H-1,2,4-triazin-5-one IUPAC Name: 6-methyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-2H-1,2,4-triazin-5-one Traditional Name: 6-methyl-3-[[4-(trifluoromethyl)benzyl]thio]-2H-1,2,4-triazin-5-one Formula: C12H10F3N3OS MolecularWeight: 301.28751

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=NNC(=NC1=O)SCC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H10F3N3OS/c1-7-10(19)16-11(18-17-7)20-6-8-2-4-9(5-3-8)12(13,14)15/h2-5H,6H2,1H3,(H,16,18,19)