3-(3-bromophenyl)-5-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-bromophenyl)-5-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(3-bromophenyl)-5-[[4-(o-tolyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(3-bromophenyl)-5-[[4-(2-methylphenyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-bromophenyl)-5-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(3-bromophenyl)-5-[[4-(o-tolyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C20H21BrN4O MolecularWeight: 413.31094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H21BrN4O/c1-15-5-2-3-8-18(15)25-11-9-24(10-12-25)14-19-22-20(23-26-19)16-6-4-7-17(21)13-16/h2-8,13H,9-12,14H2,1H3