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

Systemtic Name: 3,4-diethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-diethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-diethyl-5-[[3-(trifluoromethyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3,4-diethyl-5-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-diethyl-5-[[3-(trifluoromethyl)benzyl]thio]-1,2,4-triazole Formula: C14H16F3N3S MolecularWeight: 315.35715

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC)SCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCC1=NN=C(N1CC)SCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H16F3N3S/c1-3-12-18-19-13(20(12)4-2)21-9-10-6-5-7-11(8-10)14(15,16)17/h5-8H,3-4,9H2,1-2H3