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

Systemtic Name: 4-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide Openeye Name: 4-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide CAS Name: 4-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]-N-(4-phenoxyphenyl)butanamide IUPAC Name: 4-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]-N-(4-phenoxyphenyl)butanamide Traditional Name: 4-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]-N-(4-phenoxyphenyl)butyramide Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C=CC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H22ClN3O3/c27-20-10-8-19(9-11-20)24-16-17-26(32)30(29-24)18-4-7-25(31)28-21-12-14-23(15-13-21)33-22-5-2-1-3-6-22/h1-3,5-6,8-17H,4,7,18H2,(H,28,31)