N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-methyl-6-oxidanylidene-pyrimidin-1-yl)ethanamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-methyl-6-oxidanylidene-pyrimidin-1-yl)ethanamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-methyl-6-oxo-pyrimidin-1-yl)acetamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-(4-methyl-6-oxo-1-pyrimidinyl)acetamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-methyl-6-oxopyrimidin-1-yl)acetamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-keto-4-methyl-pyrimidin-1-yl)acetamide Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C=N1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

Isomeric SMILES

CC1=CC(=O)N(C=N1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C23H26N6O2/c1-17-13-23(31)29(16-24-17)15-22(30)25-19-8-6-7-18(14-19)20-9-10-21(27-26-20)28-11-4-2-3-5-12-28/h6-10,13-14,16H,2-5,11-12,15H2,1H3,(H,25,30)