3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole CAS Name: 3-[(4-bromophenyl)methylthio]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole Traditional Name: 3-[(4-bromobenzyl)thio]-4-ethyl-5-[1-(4-methoxyphenoxy)ethyl]-1,2,4-triazole Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C(C)OC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Br)C(C)OC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22BrN3O2S/c1-4-24-19(14(2)26-18-11-9-17(25-3)10-12-18)22-23-20(24)27-13-15-5-7-16(21)8-6-15/h5-12,14H,4,13H2,1-3H3