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

Systemtic Name: 3-cyclopropyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-cyclopropyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-cyclopropyl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-cyclopropyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-cyclopropyl-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazol-4-yl]amine Formula: C13H13F3N4S MolecularWeight: 314.32933

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2N)SCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CC1C2=NN=C(N2N)SCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C13H13F3N4S/c14-13(15,16)10-3-1-2-8(6-10)7-21-12-19-18-11(20(12)17)9-4-5-9/h1-3,6,9H,4-5,7,17H2