2-[2-[6-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[6-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[6-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[6-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-1H-benzimidazol-2-yl]ethyl]isoindoline-1,3-quinone Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC3=C(C=C2)N=C(N3)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC3=C(C=C2)N=C(N3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H19N5O3/c1-12-10-19(28)25-26-20(12)13-6-7-16-17(11-13)24-18(23-16)8-9-27-21(29)14-4-2-3-5-15(14)22(27)30/h2-7,11-12H,8-10H2,1H3,(H,23,24)(H,25,28)