3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[2-(3-bromophenoxy)ethylthio]-5-(2-methoxyphenyl)-4-methyl-1,2,4-triazole Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC(=CC=C2)Br)C3=CC=CC=C3OC

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC(=CC=C2)Br)C3=CC=CC=C3OC

InChI

InChI=1S/C18H18BrN3O2S/c1-22-17(15-8-3-4-9-16(15)23-2)20-21-18(22)25-11-10-24-14-7-5-6-13(19)12-14/h3-9,12H,10-11H2,1-2H3