2-[4-(4-pyrimidin-5-ylimidazol-1-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-pyrimidin-5-ylimidazol-1-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-pyrimidin-5-ylimidazol-1-yl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(5-pyrimidinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-pyrimidin-5-ylimidazol-1-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(5-pyrimidyl)imidazol-1-yl]butyl]isoindoline-1,3-quinone Formula: C19H17N5O2 MolecularWeight: 347.37058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=CN=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3C=C(N=C3)C4=CN=CN=C4

InChI

InChI=1S/C19H17N5O2/c25-18-15-5-1-2-6-16(15)19(26)24(18)8-4-3-7-23-11-17(22-13-23)14-9-20-12-21-10-14/h1-2,5-6,9-13H,3-4,7-8H2