3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-(4-methylphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-(4-methylphenyl)-1H-1,2,4-triazole Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-(p-tolyl)-1H-1,2,4-triazole CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-(4-methylphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-(4-methylphenyl)-1H-1,2,4-triazole Traditional Name: 3-[2-(3-bromophenoxy)ethylthio]-5-(p-tolyl)-1H-1,2,4-triazole Formula: C17H16BrN3OS MolecularWeight: 390.29744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCCOC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H16BrN3OS/c1-12-5-7-13(8-6-12)16-19-17(21-20-16)23-10-9-22-15-4-2-3-14(18)11-15/h2-8,11H,9-10H2,1H3,(H,19,20,21)