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

Systemtic Name: 3-(1-benzofuran-2-yl)-5-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazole Openeye Name: 3-(benzofuran-2-yl)-5-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazole CAS Name: 3-(2-benzofuranyl)-5-[(4-chlorophenyl)methylthio]-4-ethyl-1,2,4-triazole IUPAC Name: 3-(1-benzofuran-2-yl)-5-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazole Traditional Name: 3-(benzofuran-2-yl)-5-[(4-chlorobenzyl)thio]-4-ethyl-1,2,4-triazole Formula: C19H16ClN3OS MolecularWeight: 369.86784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN3OS/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