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

Systemtic Name: 5-cyclopropyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-cyclopropyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-cyclopropyl-3-[[4-(trifluoromethyl)phenyl]methylthio]-1H-1,2,4-triazole IUPAC Name: 5-cyclopropyl-3-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-cyclopropyl-3-[[4-(trifluoromethyl)benzyl]thio]-1H-1,2,4-triazole Formula: C13H12F3N3S MolecularWeight: 299.31469

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CC1C2=NC(=NN2)SCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C13H12F3N3S/c14-13(15,16)10-5-1-8(2-6-10)7-20-12-17-11(18-19-12)9-3-4-9/h1-2,5-6,9H,3-4,7H2,(H,17,18,19)