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

Systemtic Name: 3-cyclopropyl-4-phenyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Openeye Name: 3-cyclopropyl-4-phenyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole CAS Name: 3-cyclopropyl-4-phenyl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3-cyclopropyl-4-phenyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Traditional Name: 3-cyclopropyl-4-phenyl-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazole Formula: C19H16F3N3S MolecularWeight: 375.41065

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C19H16F3N3S/c20-19(21,22)15-6-4-5-13(11-15)12-26-18-24-23-17(14-9-10-14)25(18)16-7-2-1-3-8-16/h1-8,11,14H,9-10,12H2