4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 4-[3-(4-bromophenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-[3-(4-bromophenyl)-6-oxo-pyridazin-1-yl]-N-(3-pyridylmethyl)butanamide CAS Name: 4-[3-(4-bromophenyl)-6-oxo-1-pyridazinyl]-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-[3-(4-bromophenyl)-6-oxopyridazin-1-yl]-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 4-[3-(4-bromophenyl)-6-keto-pyridazin-1-yl]-N-(3-pyridylmethyl)butyramide Formula: C20H19BrN4O2 MolecularWeight: 427.29446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrN4O2/c21-17-7-5-16(6-8-17)18-9-10-20(27)25(24-18)12-2-4-19(26)23-14-15-3-1-11-22-13-15/h1,3,5-11,13H,2,4,12,14H2,(H,23,26)