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

Systemtic Name: 3,4-diethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-diethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-diethyl-5-[(4-fluorophenyl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-diethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-diethyl-5-[(4-fluorobenzyl)thio]-1,2,4-triazole Formula: C13H16FN3S MolecularWeight: 265.349643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16FN3S/c1-3-12-15-16-13(17(12)4-2)18-9-10-5-7-11(14)8-6-10/h5-8H,3-4,9H2,1-2H3