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

Systemtic Name: 3-(1-benzofuran-2-yl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(benzofuran-2-yl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-benzofuranyl)-4-ethyl-5-[(4-fluorophenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(1-benzofuran-2-yl)-4-ethyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(benzofuran-2-yl)-4-ethyl-5-[(4-fluorobenzyl)thio]-1,2,4-triazole Formula: C19H16FN3OS MolecularWeight: 353.413243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C19H16FN3OS/c1-2-23-18(17-11-14-5-3-4-6-16(14)24-17)21-22-19(23)25-12-13-7-9-15(20)10-8-13/h3-11H,2,12H2,1H3