2-(4-chlorophenyl)-3,7-dimethyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyrazolo[3,4-d]pyridazin-4-one

Systemtic Name: 2-(4-chlorophenyl)-3,7-dimethyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)pyrazolo[3,4-d]pyridazin-4-one Openeye Name: 2-(4-chlorophenyl)-3,7-dimethyl-5-[2-oxo-2-(1-piperidyl)ethyl]pyrazolo[3,4-d]pyridazin-4-one CAS Name: 2-(4-chlorophenyl)-3,7-dimethyl-5-[2-oxo-2-(1-piperidinyl)ethyl]-4-pyrazolo[3,4-d]pyridazinone IUPAC Name: 2-(4-chlorophenyl)-3,7-dimethyl-5-(2-oxo-2-piperidin-1-ylethyl)pyrazolo[3,4-d]pyridazin-4-one Traditional Name: 2-(4-chlorophenyl)-5-(2-keto-2-piperidino-ethyl)-3,7-dimethyl-pyrazolo[3,4-d]pyridazin-4-one Formula: C20H22ClN5O2 MolecularWeight: 399.87398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN1C3=CC=C(C=C3)Cl)C(=NN(C2=O)CC(=O)N4CCCCC4)C

Isomeric SMILES

CC1=C2C(=NN1C3=CC=C(C=C3)Cl)C(=NN(C2=O)CC(=O)N4CCCCC4)C

InChI

InChI=1S/C20H22ClN5O2/c1-13-19-18(14(2)26(23-19)16-8-6-15(21)7-9-16)20(28)25(22-13)12-17(27)24-10-4-3-5-11-24/h6-9H,3-5,10-12H2,1-2H3