2-[(4-bromophenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[(4-bromophenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[(4-bromophenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[(4-bromophenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[(4-bromophenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[(4-bromophenyl)-[4-(2-pyrimidyl)piperazino]methyl]-5-phenyl-1,3,4-oxadiazole Formula: C23H21BrN6O MolecularWeight: 477.35644

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(C3=CC=C(C=C3)Br)C4=NN=C(O4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(C3=CC=C(C=C3)Br)C4=NN=C(O4)C5=CC=CC=C5

InChI

InChI=1S/C23H21BrN6O/c24-19-9-7-17(8-10-19)20(22-28-27-21(31-22)18-5-2-1-3-6-18)29-13-15-30(16-14-29)23-25-11-4-12-26-23/h1-12,20H,13-16H2