2-(5,7-dimethoxy-4-phenyl-quinolin-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(5,7-dimethoxy-4-phenyl-quinolin-2-yl)sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(5,7-dimethoxy-4-phenyl-2-quinolyl)sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(5,7-dimethoxy-4-phenyl-2-quinolinyl)thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(5,7-dimethoxy-4-phenylquinolin-2-yl)sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(5,7-dimethoxy-4-phenyl-2-quinolyl)thio]-1-pyrrolidino-ethanone Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=CC(=NC2=C1)SCC(=O)N3CCCC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C2C(=CC(=NC2=C1)SCC(=O)N3CCCC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H24N2O3S/c1-27-17-12-19-23(20(13-17)28-2)18(16-8-4-3-5-9-16)14-21(24-19)29-15-22(26)25-10-6-7-11-25/h3-5,8-9,12-14H,6-7,10-11,15H2,1-2H3