1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone

Systemtic Name: 1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone Openeye Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-2-[3-(3-pyridyl)pyrazol-1-yl]ethanone CAS Name: 1-[2-[(2,6-dimethoxy-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-2-[3-(3-pyridinyl)-1-pyrazolyl]ethanone IUPAC Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)ethanone Traditional Name: 1-[2-(2,6-dimethoxynicotinoyl)pyrazolidin-1-yl]-2-[3-(3-pyridyl)pyrazol-1-yl]ethanone Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)C(=O)N2CCCN2C(=O)CN3C=CC(=N3)C4=CN=CC=C4)OC

Isomeric SMILES

COC1=NC(=C(C=C1)C(=O)N2CCCN2C(=O)CN3C=CC(=N3)C4=CN=CC=C4)OC

InChI

InChI=1S/C21H22N6O4/c1-30-18-7-6-16(20(23-18)31-2)21(29)27-11-4-10-26(27)19(28)14-25-12-8-17(24-25)15-5-3-9-22-13-15/h3,5-9,12-13H,4,10-11,14H2,1-2H3