3-[[5-(4-bromophenyl)furan-2-yl]methylsulfanyl]-4-(2-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 3-[[5-(4-bromophenyl)furan-2-yl]methylsulfanyl]-4-(2-methoxyphenyl)-1,2,4-triazole Openeye Name: 3-[[5-(4-bromophenyl)-2-furyl]methylsulfanyl]-4-(2-methoxyphenyl)-1,2,4-triazole CAS Name: 3-[[5-(4-bromophenyl)-2-furanyl]methylthio]-4-(2-methoxyphenyl)-1,2,4-triazole IUPAC Name: 3-[[5-(4-bromophenyl)furan-2-yl]methylsulfanyl]-4-(2-methoxyphenyl)-1,2,4-triazole Traditional Name: 3-[[5-(4-bromophenyl)-2-furyl]methylthio]-4-(2-methoxyphenyl)-1,2,4-triazole Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=NN=C2SCC3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC=C1N2C=NN=C2SCC3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H16BrN3O2S/c1-25-19-5-3-2-4-17(19)24-13-22-23-20(24)27-12-16-10-11-18(26-16)14-6-8-15(21)9-7-14/h2-11,13H,12H2,1H3