2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[7-methoxy-4-(trifluoromethyl)-2-quinolinyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[7-methoxy-4-(trifluoromethyl)quinolin-2-yl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[[7-methoxy-4-(trifluoromethyl)-2-quinolyl]thio]-1-pyrrolidino-ethanone Formula: C17H17F3N2O2S MolecularWeight: 370.38929

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CCCC3)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=N2)SCC(=O)N3CCCC3)C(F)(F)F

InChI

InChI=1S/C17H17F3N2O2S/c1-24-11-4-5-12-13(17(18,19)20)9-15(21-14(12)8-11)25-10-16(23)22-6-2-3-7-22/h4-5,8-9H,2-3,6-7,10H2,1H3