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

Systemtic Name: 5-(2-bromophenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(2-bromophenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(2-bromophenyl)-3-[2-(3-methylphenoxy)ethylthio]-1H-1,2,4-triazole IUPAC Name: 5-(2-bromophenyl)-3-[2-(3-methylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(2-bromophenyl)-3-[2-(3-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=C1)OCCSC2=NNC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NNC(=N2)C3=CC=CC=C3Br

InChI

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