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

Systemtic Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(3-fluorophenyl)butanamide Openeye Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(3-fluorophenyl)butanamide CAS Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxo-1-pyridazinyl]-N-(3-fluorophenyl)butanamide IUPAC Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]-N-(3-fluorophenyl)butanamide Traditional Name: 4-[3-(3,4-dimethoxyphenyl)-6-keto-pyridazin-1-yl]-N-(3-fluorophenyl)butyramide Formula: C22H22FN3O4 MolecularWeight: 411.426183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC(=CC=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC(=CC=C3)F)OC

InChI

InChI=1S/C22H22FN3O4/c1-29-19-10-8-15(13-20(19)30-2)18-9-11-22(28)26(25-18)12-4-7-21(27)24-17-6-3-5-16(23)14-17/h3,5-6,8-11,13-14H,4,7,12H2,1-2H3,(H,24,27)