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

Systemtic Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxidanylidene-pyrazolo[3,4-d]pyridazin-6-yl]-N-phenyl-ethanamide Openeye Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxo-pyrazolo[3,4-d]pyridazin-6-yl]-N-phenyl-acetamide CAS Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxo-6-pyrazolo[3,4-d]pyridazinyl]-N-phenylacetamide IUPAC Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-oxopyrazolo[3,4-d]pyridazin-6-yl]-N-phenylacetamide Traditional Name: 2-[1-(3-chlorophenyl)-4-cyclopropyl-7-keto-pyrazolo[3,4-d]pyridazin-6-yl]-N-phenyl-acetamide Formula: C22H18ClN5O2 MolecularWeight: 419.86362

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=O)C3=C2C=NN3C4=CC(=CC=C4)Cl)CC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=O)C3=C2C=NN3C4=CC(=CC=C4)Cl)CC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C22H18ClN5O2/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/h1-8,11-12,14H,9-10,13H2,(H,25,29)