2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxidanylidene-pyrazolo[3,4-d]pyridazin-5-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxidanylidene-pyrazolo[3,4-d]pyridazin-5-yl]-N-phenethyl-ethanamide Openeye Name: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-pyrazolo[3,4-d]pyridazin-5-yl]-N-phenethyl-acetamide CAS Name: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-5-pyrazolo[3,4-d]pyridazinyl]-N-phenethylacetamide IUPAC Name: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxopyrazolo[3,4-d]pyridazin-5-yl]-N-phenethylacetamide Traditional Name: 2-[2-(4-chlorophenyl)-4-keto-3,7-dimethyl-pyrazolo[3,4-d]pyridazin-5-yl]-N-phenethyl-acetamide Formula: C23H22ClN5O2 MolecularWeight: 435.90608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN1C3=CC=C(C=C3)Cl)C(=NN(C2=O)CC(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C2C(=NN1C3=CC=C(C=C3)Cl)C(=NN(C2=O)CC(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C23H22ClN5O2/c1-15-22-21(16(2)29(27-22)19-10-8-18(24)9-11-19)23(31)28(26-15)14-20(30)25-13-12-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3,(H,25,30)