4-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3,5-dimethoxyphenyl)butanamide

Systemtic Name: 4-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3,5-dimethoxyphenyl)butanamide Openeye Name: 4-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]-N-(3,5-dimethoxyphenyl)butanamide CAS Name: 4-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]-N-(3,5-dimethoxyphenyl)butanamide IUPAC Name: 4-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]-N-(3,5-dimethoxyphenyl)butanamide Traditional Name: 4-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]-N-(3,5-dimethoxyphenyl)butyramide Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H22ClN3O4/c1-29-18-12-17(13-19(14-18)30-2)24-21(27)4-3-11-26-22(28)10-9-20(25-26)15-5-7-16(23)8-6-15/h5-10,12-14H,3-4,11H2,1-2H3,(H,24,27)