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

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxidanylidene-4-propan-2-yl-pyrimidin-1-yl)ethanamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-isopropyl-6-oxo-pyrimidin-1-yl)acetamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-(6-oxo-4-propan-2-yl-1-pyrimidinyl)acetamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(6-oxo-4-propan-2-ylpyrimidin-1-yl)acetamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(4-isopropyl-6-keto-pyrimidin-1-yl)acetamide Formula: C25H30N6O2 MolecularWeight: 446.5447

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N(C=N1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

Isomeric SMILES

CC(C)C1=CC(=O)N(C=N1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C25H30N6O2/c1-18(2)22-15-25(33)31(17-26-22)16-24(32)27-20-9-7-8-19(14-20)21-10-11-23(29-28-21)30-12-5-3-4-6-13-30/h7-11,14-15,17-18H,3-6,12-13,16H2,1-2H3,(H,27,32)