2-butyl-4-pyrazol-1-yl-5-pyridin-3-yl-isoindole-1,3-dione

Systemtic Name: 2-butyl-4-pyrazol-1-yl-5-pyridin-3-yl-isoindole-1,3-dione Openeye Name: 2-butyl-4-pyrazol-1-yl-5-(3-pyridyl)isoindoline-1,3-dione CAS Name: 2-butyl-4-(1-pyrazolyl)-5-(3-pyridinyl)isoindole-1,3-dione IUPAC Name: 2-butyl-4-pyrazol-1-yl-5-pyridin-3-ylisoindole-1,3-dione Traditional Name: 2-butyl-4-pyrazol-1-yl-5-(3-pyridyl)isoindoline-1,3-quinone Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C(=C(C=C2)C3=CN=CC=C3)N4C=CC=N4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C(=C(C=C2)C3=CN=CC=C3)N4C=CC=N4

InChI

InChI=1S/C20H18N4O2/c1-2-3-11-23-19(25)16-8-7-15(14-6-4-9-21-13-14)18(17(16)20(23)26)24-12-5-10-22-24/h4-10,12-13H,2-3,11H2,1H3