1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)but-2-ynyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)but-2-ynyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)but-2-ynyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[4-(2-pyrimidinyl)-1-piperazinyl]but-2-ynyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)but-2-ynyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-[4-(2-pyrimidyl)piperazino]but-2-ynyl]pyrrolidine-2,5-quinone Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CC#CCN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

C1CC(=O)N(C1=O)CC#CCN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C16H19N5O2/c22-14-4-5-15(23)21(14)9-2-1-8-19-10-12-20(13-11-19)16-17-6-3-7-18-16/h3,6-7H,4-5,8-13H2