N-(3-acetamidophenyl)-4-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)butanamide

Systemtic Name: N-(3-acetamidophenyl)-4-(6-oxidanylidene-3-pyridin-4-yl-pyridazin-1-yl)butanamide Openeye Name: N-(3-acetamidophenyl)-4-[6-oxo-3-(4-pyridyl)pyridazin-1-yl]butanamide CAS Name: N-(3-acetamidophenyl)-4-(6-oxo-3-pyridin-4-yl-1-pyridazinyl)butanamide IUPAC Name: N-(3-acetamidophenyl)-4-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)butanamide Traditional Name: N-(3-acetamidophenyl)-4-[6-keto-3-(4-pyridyl)pyridazin-1-yl]butyramide Formula: C21H21N5O3 MolecularWeight: 391.42314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C21H21N5O3/c1-15(27)23-17-4-2-5-18(14-17)24-20(28)6-3-13-26-21(29)8-7-19(25-26)16-9-11-22-12-10-16/h2,4-5,7-12,14H,3,6,13H2,1H3,(H,23,27)(H,24,28)