[2-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylpyrazolidin-1-yl]-(4-methoxyquinolin-2-yl)methanone

Systemtic Name: [2-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)carbonylpyrazolidin-1-yl]-(4-methoxyquinolin-2-yl)methanone Openeye Name: [2-(5-chloro-2-methylsulfonyl-pyrimidine-4-carbonyl)pyrazolidin-1-yl]-(4-methoxy-2-quinolyl)methanone CAS Name: [2-[(5-chloro-2-methylsulfonyl-4-pyrimidinyl)-oxomethyl]-1-pyrazolidinyl]-(4-methoxy-2-quinolinyl)methanone IUPAC Name: [2-(5-chloro-2-methylsulfonylpyrimidine-4-carbonyl)pyrazolidin-1-yl]-(4-methoxyquinolin-2-yl)methanone Traditional Name: [2-(5-chloro-2-mesyl-pyrimidine-4-carbonyl)pyrazolidin-1-yl]-(4-methoxy-2-quinolyl)methanone Formula: C20H18ClN5O5S MolecularWeight: 475.90542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)C4=NC(=NC=C4Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)C4=NC(=NC=C4Cl)S(=O)(=O)C

InChI

InChI=1S/C20H18ClN5O5S/c1-31-16-10-15(23-14-7-4-3-6-12(14)16)18(27)25-8-5-9-26(25)19(28)17-13(21)11-22-20(24-17)32(2,29)30/h3-4,6-7,10-11H,5,8-9H2,1-2H3