3-(phenylmethylsulfanyl)-5-(trifluoromethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(phenylmethylsulfanyl)-5-(trifluoromethyl)-1,2,4-triazol-4-amine Openeye Name: 3-benzylsulfanyl-5-(trifluoromethyl)-1,2,4-triazol-4-amine CAS Name: 3-(phenylmethylthio)-5-(trifluoromethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-benzylsulfanyl-5-(trifluoromethyl)-1,2,4-triazol-4-amine Traditional Name: [3-(benzylthio)-5-(trifluoromethyl)-1,2,4-triazol-4-yl]amine Formula: C10H9F3N4S MolecularWeight: 274.26547

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9F3N4S/c11-10(12,13)8-15-16-9(17(8)14)18-6-7-4-2-1-3-5-7/h1-5H,6,14H2