1-methyl-3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-3-(4-phenylphenyl)pyrrolidine-2,5-dione

Systemtic Name: 1-methyl-3-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-3-(4-phenylphenyl)pyrrolidine-2,5-dione Openeye Name: 1-methyl-3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-3-(4-phenylphenyl)pyrrolidine-2,5-dione CAS Name: 1-methyl-3-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-3-(4-phenylphenyl)pyrrolidine-2,5-dione IUPAC Name: 1-methyl-3-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-3-(4-phenylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]-1-methyl-3-(4-phenylphenyl)pyrrolidine-2,5-quinone Formula: C27H27N5O3 MolecularWeight: 469.53498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC(C1=O)(CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)CC(C1=O)(CC(=O)N2CCN(CC2)C3=NC=CC=N3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N5O3/c1-30-23(33)18-27(25(30)35,22-10-8-21(9-11-22)20-6-3-2-4-7-20)19-24(34)31-14-16-32(17-15-31)26-28-12-5-13-29-26/h2-13H,14-19H2,1H3