3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-4-(3-methoxyphenyl)-1,2,4-triazole

Systemtic Name: 3-[2-(2-bromanyl-4-chloranyl-phenoxy)ethylsulfanyl]-4-(3-methoxyphenyl)-1,2,4-triazole Openeye Name: 3-[2-(2-bromo-4-chloro-phenoxy)ethylsulfanyl]-4-(3-methoxyphenyl)-1,2,4-triazole CAS Name: 3-[2-(2-bromo-4-chlorophenoxy)ethylthio]-4-(3-methoxyphenyl)-1,2,4-triazole IUPAC Name: 3-[2-(2-bromo-4-chlorophenoxy)ethylsulfanyl]-4-(3-methoxyphenyl)-1,2,4-triazole Traditional Name: 3-[2-(2-bromo-4-chloro-phenoxy)ethylthio]-4-(3-methoxyphenyl)-1,2,4-triazole Formula: C17H15BrClN3O2S MolecularWeight: 440.7419

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=NN=C2SCCOC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

COC1=CC=CC(=C1)N2C=NN=C2SCCOC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C17H15BrClN3O2S/c1-23-14-4-2-3-13(10-14)22-11-20-21-17(22)25-8-7-24-16-6-5-12(19)9-15(16)18/h2-6,9-11H,7-8H2,1H3