4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorophenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-[(4-ethylphenoxy)methyl]-5-[(3-fluorobenzyl)thio]-1,2,4-triazole Formula: C20H22FN3OS MolecularWeight: 371.471583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC3=CC(=CC=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(N2CC)SCC3=CC(=CC=C3)F

InChI

InChI=1S/C20H22FN3OS/c1-3-15-8-10-18(11-9-15)25-13-19-22-23-20(24(19)4-2)26-14-16-6-5-7-17(21)12-16/h5-12H,3-4,13-14H2,1-2H3