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

Systemtic Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine CAS Name: 3-[[4-(methylthio)phenyl]methylthio]-5-(trifluoromethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[[4-(methylthio)benzyl]thio]-5-(trifluoromethyl)-1,2,4-triazol-4-yl]amine Formula: C11H11F3N4S2 MolecularWeight: 320.35705

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(N2N)C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(N2N)C(F)(F)F

InChI

InChI=1S/C11H11F3N4S2/c1-19-8-4-2-7(3-5-8)6-20-10-17-16-9(18(10)15)11(12,13)14/h2-5H,6,15H2,1H3