1,4-bis[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione

Systemtic Name: 1,4-bis[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Openeye Name: 1,4-bis[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione CAS Name: 1,4-bis[[4-(2-pyrimidinylamino)phenyl]methyl]piperazine-2,3-dione IUPAC Name: 1,4-bis[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Traditional Name: 1,4-bis[4-(2-pyrimidylamino)benzyl]piperazine-2,3-quinone Formula: C26H24N8O2 MolecularWeight: 480.52116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)NC3=NC=CC=N3)CC4=CC=C(C=C4)NC5=NC=CC=N5

Isomeric SMILES

C1CN(C(=O)C(=O)N1CC2=CC=C(C=C2)NC3=NC=CC=N3)CC4=CC=C(C=C4)NC5=NC=CC=N5

InChI

InChI=1S/C26H24N8O2/c35-23-24(36)34(18-20-5-9-22(10-6-20)32-26-29-13-2-14-30-26)16-15-33(23)17-19-3-7-21(8-4-19)31-25-27-11-1-12-28-25/h1-14H,15-18H2,(H,27,28,31)(H,29,30,32)