6-chloranyl-4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1-(phenylmethyl)quinoxaline-2,3-dione

Systemtic Name: 6-chloranyl-4-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-1-(phenylmethyl)quinoxaline-2,3-dione Openeye Name: 1-benzyl-6-chloro-4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinoxaline-2,3-dione CAS Name: 6-chloro-4-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-1-(phenylmethyl)quinoxaline-2,3-dione IUPAC Name: 1-benzyl-6-chloro-4-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]quinoxaline-2,3-dione Traditional Name: 1-benzyl-6-chloro-4-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]quinoxaline-2,3-quinone Formula: C25H23ClN6O3 MolecularWeight: 490.94152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=C(C=CC(=C4)Cl)N(C(=O)C3=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=C(C=CC(=C4)Cl)N(C(=O)C3=O)CC5=CC=CC=C5

InChI

InChI=1S/C25H23ClN6O3/c26-19-7-8-20-21(15-19)32(24(35)23(34)31(20)16-18-5-2-1-3-6-18)17-22(33)29-11-13-30(14-12-29)25-27-9-4-10-28-25/h1-10,15H,11-14,16-17H2