4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)butanamide

Systemtic Name: 4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)butanamide Openeye Name: 4-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)butanamide CAS Name: 4-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]-N-(2-methoxy-5-methylphenyl)butanamide IUPAC Name: 4-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]-N-(2-methoxy-5-methylphenyl)butanamide Traditional Name: 4-[3-(4-bromophenyl)-6-keto-pyridazin-1-yl]-N-(2-methoxy-5-methyl-phenyl)butyramide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H22BrN3O3/c1-15-5-11-20(29-2)19(14-15)24-21(27)4-3-13-26-22(28)12-10-18(25-26)16-6-8-17(23)9-7-16/h5-12,14H,3-4,13H2,1-2H3,(H,24,27)