2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]-N-cyclohexyl-ethanamide Openeye Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxo-pyrazolo[3,4-d]pyridazin-6-yl]-N-cyclohexyl-acetamide CAS Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxo-6-pyrazolo[3,4-d]pyridazinyl]-N-cyclohexylacetamide IUPAC Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxopyrazolo[3,4-d]pyridazin-6-yl]-N-cyclohexylacetamide Traditional Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-keto-pyrazolo[3,4-d]pyridazin-6-yl]-N-cyclohexyl-acetamide Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN2C(=O)C3=C(C=NN3C4=CC(=CC=C4)Cl)C(=N2)C5CC5

Isomeric SMILES

C1CCC(CC1)NC(=O)CN2C(=O)C3=C(C=NN3C4=CC(=CC=C4)Cl)C(=N2)C5CC5

InChI

InChI=1S/C22H24ClN5O2/c23-15-5-4-8-17(11-15)28-21-18(12-24-28)20(14-9-10-14)26-27(22(21)30)13-19(29)25-16-6-2-1-3-7-16/h4-5,8,11-12,14,16H,1-3,6-7,9-10,13H2,(H,25,29)