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

Systemtic Name: 3-(3,5-dimethoxyphenyl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(3,5-dimethoxyphenyl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(3,5-dimethoxyphenyl)-4-ethyl-5-[(4-fluorophenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(3,5-dimethoxyphenyl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(3,5-dimethoxyphenyl)-4-ethyl-5-[(4-fluorobenzyl)thio]-1,2,4-triazole Formula: C19H20FN3O2S MolecularWeight: 373.444403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C19H20FN3O2S/c1-4-23-18(14-9-16(24-2)11-17(10-14)25-3)21-22-19(23)26-12-13-5-7-15(20)8-6-13/h5-11H,4,12H2,1-3H3