4-cyclopropyl-1-(2,4-dimethylphenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazolo[3,4-d]pyridazin-7-one

Systemtic Name: 4-cyclopropyl-1-(2,4-dimethylphenyl)-6-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrazolo[3,4-d]pyridazin-7-one Openeye Name: 4-cyclopropyl-1-(2,4-dimethylphenyl)-6-(2-oxo-2-pyrrolidin-1-yl-ethyl)pyrazolo[3,4-d]pyridazin-7-one CAS Name: 4-cyclopropyl-1-(2,4-dimethylphenyl)-6-[2-oxo-2-(1-pyrrolidinyl)ethyl]-7-pyrazolo[3,4-d]pyridazinone IUPAC Name: 4-cyclopropyl-1-(2,4-dimethylphenyl)-6-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazolo[3,4-d]pyridazin-7-one Traditional Name: 4-cyclopropyl-1-(2,4-dimethylphenyl)-6-(2-keto-2-pyrrolidino-ethyl)pyrazolo[3,4-d]pyridazin-7-one Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NN(C3=O)CC(=O)N4CCCC4)C5CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C3=C(C=N2)C(=NN(C3=O)CC(=O)N4CCCC4)C5CC5)C

InChI

InChI=1S/C22H25N5O2/c1-14-5-8-18(15(2)11-14)27-21-17(12-23-27)20(16-6-7-16)24-26(22(21)29)13-19(28)25-9-3-4-10-25/h5,8,11-12,16H,3-4,6-7,9-10,13H2,1-2H3