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

Systemtic Name: 4-[3-(4-methylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(pyridin-4-ylmethyl)butanamide Openeye Name: 4-[6-oxo-3-(p-tolyl)pyridazin-1-yl]-N-(4-pyridylmethyl)butanamide CAS Name: 4-[3-(4-methylphenyl)-6-oxo-1-pyridazinyl]-N-(pyridin-4-ylmethyl)butanamide IUPAC Name: 4-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]-N-(pyridin-4-ylmethyl)butanamide Traditional Name: 4-[6-keto-3-(p-tolyl)pyridazin-1-yl]-N-(4-pyridylmethyl)butyramide Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H22N4O2/c1-16-4-6-18(7-5-16)19-8-9-21(27)25(24-19)14-2-3-20(26)23-15-17-10-12-22-13-11-17/h4-13H,2-3,14-15H2,1H3,(H,23,26)