3-chloranyl-1-(2-chloranylpyridin-4-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-1-(2-chloranylpyridin-4-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 3-chloro-1-(2-chloro-4-pyridyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 3-chloro-1-(2-chloro-4-pyridinyl)-4-[4-(2-pyrimidinyl)-1-piperazinyl]pyrrole-2,5-dione IUPAC Name: 3-chloro-1-(2-chloropyridin-4-yl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 3-chloro-1-(2-chloro-4-pyridyl)-4-[4-(2-pyrimidyl)piperazino]-3-pyrroline-2,5-quinone Formula: C17H14Cl2N6O2 MolecularWeight: 405.23806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14Cl2N6O2/c18-12-10-11(2-5-20-12)25-15(26)13(19)14(16(25)27)23-6-8-24(9-7-23)17-21-3-1-4-22-17/h1-5,10H,6-9H2