1-ethyl-6-fluoranyl-3-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-7-piperidin-1-yl-quinolin-4-one

Systemtic Name: 1-ethyl-6-fluoranyl-3-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-7-piperidin-1-yl-quinolin-4-one Openeye Name: 1-ethyl-6-fluoro-3-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-7-(1-piperidyl)quinolin-4-one CAS Name: 1-ethyl-6-fluoro-3-[3-[4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]-7-(1-piperidinyl)-4-quinolinone IUPAC Name: 1-ethyl-6-fluoro-3-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-7-piperidin-1-ylquinolin-4-one Traditional Name: 1-ethyl-6-fluoro-3-[3-[4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]-7-piperidino-4-quinolone Formula: C25H25FN4O2S MolecularWeight: 464.555003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCC3)F)C4=NC(=NO4)C5=CC=C(C=C5)SC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCCC3)F)C4=NC(=NO4)C5=CC=C(C=C5)SC

InChI

InChI=1S/C25H25FN4O2S/c1-3-29-15-19(25-27-24(28-32-25)16-7-9-17(33-2)10-8-16)23(31)18-13-20(26)22(14-21(18)29)30-11-5-4-6-12-30/h7-10,13-15H,3-6,11-12H2,1-2H3