6-fluoranyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-2-phenyl-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(3-methylbut-2-enyl)-4-oxidanylidene-2-phenyl-7-thiomorpholin-4-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenyl-7-thiomorpholino-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenyl-7-thiomorpholin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(3-methylbut-2-enyl)-4-oxo-2-phenyl-7-thiomorpholin-4-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-1-(3-methylbut-2-enyl)-2-phenyl-7-thiomorpholino-quinoline-3-carboxylic acid Formula: C25H25FN2O3S MolecularWeight: 452.541003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=CC(=C(C=C2C(=O)C(=C1C3=CC=CC=C3)C(=O)O)F)N4CCSCC4)C

Isomeric SMILES

CC(=CCN1C2=CC(=C(C=C2C(=O)C(=C1C3=CC=CC=C3)C(=O)O)F)N4CCSCC4)C

InChI

InChI=1S/C25H25FN2O3S/c1-16(2)8-9-28-20-15-21(27-10-12-32-13-11-27)19(26)14-18(20)24(29)22(25(30)31)23(28)17-6-4-3-5-7-17/h3-8,14-15H,9-13H2,1-2H3,(H,30,31)