ethyl 8-fluoranyl-2-hexylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 8-fluoranyl-2-hexylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 8-fluoro-2-hexylsulfanyl-4-oxo-1H-quinoline-3-carboxylate CAS Name: 8-fluoro-2-(hexylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-fluoro-2-hexylsulfanyl-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 8-fluoro-2-(hexylthio)-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C18H22FNO3S MolecularWeight: 351.435583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(=O)C2=C(N1)C(=CC=C2)F)C(=O)OCC

Isomeric SMILES

CCCCCCSC1=C(C(=O)C2=C(N1)C(=CC=C2)F)C(=O)OCC

InChI

InChI=1S/C18H22FNO3S/c1-3-5-6-7-11-24-17-14(18(22)23-4-2)16(21)12-9-8-10-13(19)15(12)20-17/h8-10H,3-7,11H2,1-2H3,(H,20,21)