3,4-dimethyl-6-(1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl)-2-phenyl-pyrazolo[3,4-d]pyridazin-7-one

Systemtic Name: 3,4-dimethyl-6-(1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl)-2-phenyl-pyrazolo[3,4-d]pyridazin-7-one Openeye Name: 3,4-dimethyl-2-phenyl-6-[1-(pyrrolidine-1-carbonyl)propyl]pyrazolo[3,4-d]pyridazin-7-one CAS Name: 3,4-dimethyl-6-[1-oxo-1-(1-pyrrolidinyl)butan-2-yl]-2-phenyl-7-pyrazolo[3,4-d]pyridazinone IUPAC Name: 3,4-dimethyl-6-(1-oxo-1-pyrrolidin-1-ylbutan-2-yl)-2-phenylpyrazolo[3,4-d]pyridazin-7-one Traditional Name: 3,4-dimethyl-2-phenyl-6-[1-(pyrrolidine-1-carbonyl)propyl]pyrazolo[3,4-d]pyridazin-7-one Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCC1)N2C(=O)C3=NN(C(=C3C(=N2)C)C)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)N1CCCC1)N2C(=O)C3=NN(C(=C3C(=N2)C)C)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5O2/c1-4-17(20(27)24-12-8-9-13-24)26-21(28)19-18(14(2)22-26)15(3)25(23-19)16-10-6-5-7-11-16/h5-7,10-11,17H,4,8-9,12-13H2,1-3H3