4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[(3-methoxyphenyl)methyl]butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H22BrN3O3/c1-29-19-5-2-4-16(14-19)15-24-21(27)6-3-13-26-22(28)12-11-20(25-26)17-7-9-18(23)10-8-17/h2,4-5,7-12,14H,3,6,13,15H2,1H3,(H,24,27)