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

Systemtic Name: 1-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-(2-pyridylthio)ethanone Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O3S/c1-28-18-13-17(23-16-8-3-2-7-15(16)18)21(27)25-12-6-11-24(25)20(26)14-29-19-9-4-5-10-22-19/h2-5,7-10,13H,6,11-12,14H2,1H3