3-but-2-ynyl-5-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one

Systemtic Name: 3-but-2-ynyl-5-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one Openeye Name: 3-but-2-ynyl-5-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one CAS Name: 3-but-2-ynyl-5-[(4,6-dimethyl-2-pyrimidinyl)methyl]-2-(1-piperazinyl)-4-imidazo[4,5-d]pyridazinone IUPAC Name: 3-but-2-ynyl-5-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperazin-1-ylimidazo[4,5-d]pyridazin-4-one Traditional Name: 3-but-2-ynyl-5-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperazino-imidazo[4,5-d]pyridazin-4-one Formula: C20H24N8O MolecularWeight: 392.45756

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(C=NN(C2=O)CC3=NC(=CC(=N3)C)C)N=C1N4CCNCC4

Isomeric SMILES

CC#CCN1C2=C(C=NN(C2=O)CC3=NC(=CC(=N3)C)C)N=C1N4CCNCC4

InChI

InChI=1S/C20H24N8O/c1-4-5-8-27-18-16(25-20(27)26-9-6-21-7-10-26)12-22-28(19(18)29)13-17-23-14(2)11-15(3)24-17/h11-12,21H,6-10,13H2,1-3H3