3-[[(2,2-dimethyloxan-4-yl)amino]methyl]-7-fluoranyl-1-(2-phenylsulfanylethyl)quinolin-2-one

Systemtic Name: 3-[[(2,2-dimethyloxan-4-yl)amino]methyl]-7-fluoranyl-1-(2-phenylsulfanylethyl)quinolin-2-one Openeye Name: 3-[[(2,2-dimethyltetrahydropyran-4-yl)amino]methyl]-7-fluoro-1-(2-phenylsulfanylethyl)quinolin-2-one CAS Name: 3-[[(2,2-dimethyl-4-oxanyl)amino]methyl]-7-fluoro-1-[2-(phenylthio)ethyl]-2-quinolinone IUPAC Name: 3-[[(2,2-dimethyloxan-4-yl)amino]methyl]-7-fluoro-1-(2-phenylsulfanylethyl)quinolin-2-one Traditional Name: 3-[[(2,2-dimethyltetrahydropyran-4-yl)amino]methyl]-7-fluoro-1-[2-(phenylthio)ethyl]carbostyril Formula: C25H29FN2O2S MolecularWeight: 440.573363

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)NCC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CCO1)NCC2=CC3=C(C=C(C=C3)F)N(C2=O)CCSC4=CC=CC=C4)C

InChI

InChI=1S/C25H29FN2O2S/c1-25(2)16-21(10-12-30-25)27-17-19-14-18-8-9-20(26)15-23(18)28(24(19)29)11-13-31-22-6-4-3-5-7-22/h3-9,14-15,21,27H,10-13,16-17H2,1-2H3