N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1-methyl-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1-methyl-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1-methyl-2-oxo-pyridine-3-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-1-methyl-2-oxo-3-pyridinecarboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1-methyl-2-oxopyridine-3-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-keto-1-methyl-nicotinamide Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C(C1=O)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

Isomeric SMILES

CN1C=CC=C(C1=O)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C23H25N5O2/c1-27-13-7-10-19(23(27)30)22(29)24-18-9-6-8-17(16-18)20-11-12-21(26-25-20)28-14-4-2-3-5-15-28/h6-13,16H,2-5,14-15H2,1H3,(H,24,29)