5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-[2-(2-methylphenoxy)ethylthio]-1H-1,2,4-triazole Formula: C17H16BrN3OS MolecularWeight: 390.29744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC2=NNC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

CC1=CC=CC=C1OCCSC2=NNC(=N2)C3=CC=CC=C3Br

InChI

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