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

Systemtic Name: 1-(4-bromophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 1-(4-bromophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 1-(4-bromophenyl)-3-[4-(2-pyrimidinyl)-1-piperazinyl]pyrrole-2,5-dione IUPAC Name: 1-(4-bromophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 1-(4-bromophenyl)-3-[4-(2-pyrimidyl)piperazino]-3-pyrroline-2,5-quinone Formula: C18H16BrN5O2 MolecularWeight: 414.25594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN5O2/c19-13-2-4-14(5-3-13)24-16(25)12-15(17(24)26)22-8-10-23(11-9-22)18-20-6-1-7-21-18/h1-7,12H,8-11H2