3-phenyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-phenyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione Openeye Name: 3-phenyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione CAS Name: 3-phenyl-4-[4-(2-pyrimidinyl)-1-piperazinyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-phenyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)cyclobut-3-ene-1,2-dione Traditional Name: 3-phenyl-4-[4-(2-pyrimidyl)piperazino]cyclobut-3-ene-1,2-quinone Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)C2=O)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)C2=O)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C18H16N4O2/c23-16-14(13-5-2-1-3-6-13)15(17(16)24)21-9-11-22(12-10-21)18-19-7-4-8-20-18/h1-8H,9-12H2