2-[4-(4-methyl-5-pyridin-3-yl-imidazol-1-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-methyl-5-pyridin-3-yl-imidazol-1-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-methyl-5-(3-pyridyl)imidazol-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-methyl-5-(3-pyridinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-methyl-5-pyridin-3-ylimidazol-1-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-methyl-5-(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=C(N(C=N1)CCCCN2C(=O)C3=CC=CC=C3C2=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(N(C=N1)CCCCN2C(=O)C3=CC=CC=C3C2=O)C4=CN=CC=C4

InChI

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