2-[4-[4-(6-chloranyl-5-methyl-pyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(6-chloranyl-5-methyl-pyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(6-chloro-5-methyl-3-pyridyl)imidazol-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(6-chloro-5-methyl-3-pyridinyl)-1-imidazolyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(6-chloro-5-methylpyridin-3-yl)imidazol-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(6-chloro-5-methyl-3-pyridyl)imidazol-1-yl]butyl]isoindoline-1,3-quinone Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN4O2/c1-14-10-15(11-23-19(14)22)18-12-25(13-24-18)8-4-5-9-26-20(27)16-6-2-3-7-17(16)21(26)28/h2-3,6-7,10-13H,4-5,8-9H2,1H3