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

Systemtic Name: 4-phenyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Openeye Name: 4-phenyl-3-(2-thienyl)-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole CAS Name: 4-phenyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 4-phenyl-3-thiophen-2-yl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Traditional Name: 4-phenyl-3-(2-thienyl)-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazole Formula: C20H14F3N3S2 MolecularWeight: 417.47047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C20H14F3N3S2/c21-20(22,23)15-7-4-6-14(12-15)13-28-19-25-24-18(17-10-5-11-27-17)26(19)16-8-2-1-3-9-16/h1-12H,13H2