N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxidanylidenepyrimidin-1-yl)ethanamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxidanylidenepyrimidin-1-yl)ethanamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxopyrimidin-1-yl)acetamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-(6-oxo-1-pyrimidinyl)acetamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxopyrimidin-1-yl)acetamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-ketopyrimidin-1-yl)acetamide Formula: C22H24N6O2 MolecularWeight: 404.46496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CN4C=NC=CC4=O

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)CN4C=NC=CC4=O

InChI

InChI=1S/C22H24N6O2/c29-21(15-28-16-23-11-10-22(28)30)24-18-7-5-6-17(14-18)19-8-9-20(26-25-19)27-12-3-1-2-4-13-27/h5-11,14,16H,1-4,12-13,15H2,(H,24,29)