1-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-(4-pyridin-2-ylpyrimidin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-(4-pyridin-2-ylpyrimidin-2-yl)sulfanyl-ethanone Openeye Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-[4-(2-pyridyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-2-[[4-(2-pyridinyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-(4-pyridin-2-ylpyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-[[4-(2-pyridyl)pyrimidin-2-yl]thio]ethanone Formula: C25H22N6O3S MolecularWeight: 486.54558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CSC4=NC=CC(=N4)C5=CC=CC=N5

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CSC4=NC=CC(=N4)C5=CC=CC=N5

InChI

InChI=1S/C25H22N6O3S/c1-34-22-15-21(28-18-8-3-2-7-17(18)22)24(33)31-14-6-13-30(31)23(32)16-35-25-27-12-10-20(29-25)19-9-4-5-11-26-19/h2-5,7-12,15H,6,13-14,16H2,1H3