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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H21BrN4O/c21-18-8-4-7-17(13-18)20-22-19(26-23-20)15-25-11-9-24(10-12-25)14-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2