3-[(4-methylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-methylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Openeye Name: 3-(p-tolylmethylsulfanyl)-5-(trifluoromethyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-methylphenyl)methylthio]-5-(trifluoromethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-methylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-methylbenzyl)thio]-5-(trifluoromethyl)-1,2,4-triazol-4-yl]amine Formula: C11H11F3N4S MolecularWeight: 288.29205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2N)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2N)C(F)(F)F

InChI

InChI=1S/C11H11F3N4S/c1-7-2-4-8(5-3-7)6-19-10-17-16-9(18(10)15)11(12,13)14/h2-5H,6,15H2,1H3