3-[(4-bromophenyl)methylsulfanyl]-5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(7-methoxybenzofuran-2-yl)-4-methyl-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-5-(7-methoxy-2-benzofuranyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-5-(7-methoxybenzofuran-2-yl)-4-methyl-1,2,4-triazole Formula: C19H16BrN3O2S MolecularWeight: 430.31824

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C19H16BrN3O2S/c1-23-18(16-10-13-4-3-5-15(24-2)17(13)25-16)21-22-19(23)26-11-12-6-8-14(20)9-7-12/h3-10H,11H2,1-2H3