1-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-3-(methylthio)propan-1-one Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CCSC

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCCN3C(=O)CCSC

InChI

InChI=1S/C18H21N3O3S/c1-24-16-12-15(19-14-7-4-3-6-13(14)16)18(23)21-10-5-9-20(21)17(22)8-11-25-2/h3-4,6-7,12H,5,8-11H2,1-2H3