N-(4-bromophenyl)-2-[3-oxidanylidene-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoyl]piperazin-2-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[3-oxidanylidene-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanoyl]piperazin-2-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[3-oxo-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]piperazin-2-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[3-oxo-1-[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-2-piperazinyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[3-oxo-1-[2-(4-pyrimidin-2-ylpiperazin-1-yl)acetyl]piperazin-2-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[3-keto-1-[2-[4-(2-pyrimidyl)piperazino]acetyl]piperazin-2-yl]acetamide Formula: C22H26BrN7O3 MolecularWeight: 516.39094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NC2=CC=C(C=C2)Br)C(=O)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NC2=CC=C(C=C2)Br)C(=O)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H26BrN7O3/c23-16-2-4-17(5-3-16)27-19(31)14-18-21(33)24-8-9-30(18)20(32)15-28-10-12-29(13-11-28)22-25-6-1-7-26-22/h1-7,18H,8-15H2,(H,24,33)(H,27,31)