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

Systemtic Name: 4-azanyl-6-methyl-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazin-5-one Openeye Name: 4-amino-6-methyl-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazin-5-one CAS Name: 4-amino-6-methyl-3-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazin-5-one IUPAC Name: 4-amino-6-methyl-3-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazin-5-one Traditional Name: 4-amino-6-methyl-3-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazin-5-one Formula: C12H11F3N4OS MolecularWeight: 316.30215

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N(C1=O)N)SCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC1=NN=C(N(C1=O)N)SCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C12H11F3N4OS/c1-7-10(20)19(16)11(18-17-7)21-6-8-3-2-4-9(5-8)12(13,14)15/h2-5H,6,16H2,1H3