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

Systemtic Name: 1-(3-phenylpropyl)-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Openeye Name: 1-(3-phenylpropyl)-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione CAS Name: 1-(3-phenylpropyl)-4-[[4-(2-pyrimidinylamino)phenyl]methyl]piperazine-2,3-dione IUPAC Name: 1-(3-phenylpropyl)-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Traditional Name: 1-(3-phenylpropyl)-4-[4-(2-pyrimidylamino)benzyl]piperazine-2,3-quinone Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C(=O)N1CCCC2=CC=CC=C2)CC3=CC=C(C=C3)NC4=NC=CC=N4

Isomeric SMILES

C1CN(C(=O)C(=O)N1CCCC2=CC=CC=C2)CC3=CC=C(C=C3)NC4=NC=CC=N4

InChI

InChI=1S/C24H25N5O2/c30-22-23(31)29(17-16-28(22)15-4-8-19-6-2-1-3-7-19)18-20-9-11-21(12-10-20)27-24-25-13-5-14-26-24/h1-3,5-7,9-14H,4,8,15-18H2,(H,25,26,27)