2-[4-[4-(6-methylpyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(6-methylpyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(6-methyl-3-pyridyl)imidazol-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(6-methyl-3-pyridinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(6-methylpyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(6-methyl-3-pyridyl)imidazol-1-yl]butyl]isoindoline-1,3-quinone Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=CN(C=N2)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=NC=C(C=C1)C2=CN(C=N2)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20N4O2/c1-15-8-9-16(12-22-15)19-13-24(14-23-19)10-4-5-11-25-20(26)17-6-2-3-7-18(17)21(25)27/h2-3,6-9,12-14H,4-5,10-11H2,1H3