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

Systemtic Name: 2-(3-bromophenyl)-5-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole Openeye Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-5-(3-bromophenyl)-1,3,4-oxadiazole CAS Name: 2-(3-bromophenyl)-5-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole IUPAC Name: 2-[(4-benzhydrylpiperazin-1-yl)methyl]-5-(3-bromophenyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-benzhydrylpiperazino)methyl]-5-(3-bromophenyl)-1,3,4-oxadiazole Formula: C26H25BrN4O MolecularWeight: 489.4069

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NN=C(O2)C3=CC(=CC=C3)Br)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NN=C(O2)C3=CC(=CC=C3)Br)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25BrN4O/c27-23-13-7-12-22(18-23)26-29-28-24(32-26)19-30-14-16-31(17-15-30)25(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-13,18,25H,14-17,19H2