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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrN3O3/c1-29-19-10-4-16(5-11-19)15-24-21(27)3-2-14-26-22(28)13-12-20(25-26)17-6-8-18(23)9-7-17/h4-13H,2-3,14-15H2,1H3,(H,24,27)