4-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[(4-methylphenyl)methyl]butanamide

Systemtic Name: 4-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[(4-methylphenyl)methyl]butanamide Openeye Name: 4-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]-N-(p-tolylmethyl)butanamide CAS Name: 4-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]-N-[(4-methylphenyl)methyl]butanamide IUPAC Name: 4-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]-N-[(4-methylphenyl)methyl]butanamide Traditional Name: 4-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]-N-(4-methylbenzyl)butyramide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H22ClN3O2/c1-16-4-6-17(7-5-16)15-24-21(27)3-2-14-26-22(28)13-12-20(25-26)18-8-10-19(23)11-9-18/h4-13H,2-3,14-15H2,1H3,(H,24,27)