5-thiophen-2-yl-3-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-thiophen-2-yl-3-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-thienyl)-3-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-thiophen-2-yl-3-[[2-(trifluoromethyl)phenyl]methylthio]-1H-1,2,4-triazole IUPAC Name: 5-thiophen-2-yl-3-[[2-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-thienyl)-3-[[2-(trifluoromethyl)benzyl]thio]-1H-1,2,4-triazole Formula: C14H10F3N3S2 MolecularWeight: 341.37451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CS3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NNC(=N2)C3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C14H10F3N3S2/c15-14(16,17)10-5-2-1-4-9(10)8-22-13-18-12(19-20-13)11-6-3-7-21-11/h1-7H,8H2,(H,18,19,20)