N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-2,6-dimethyl-quinoline-4-carboxamide

Systemtic Name: N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)-2,6-dimethyl-quinoline-4-carboxamide Openeye Name: N-(4-fluoro-3-morpholinosulfonyl-phenyl)-2,6-dimethyl-quinoline-4-carboxamide CAS Name: N-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]-2,6-dimethyl-4-quinolinecarboxamide IUPAC Name: N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)-2,6-dimethylquinoline-4-carboxamide Traditional Name: N-(4-fluoro-3-morpholinosulfonyl-phenyl)-2,6-dimethyl-cinchoninamide Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=CC(=C(C=C3)F)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C22H22FN3O4S/c1-14-3-6-20-17(11-14)18(12-15(2)24-20)22(27)25-16-4-5-19(23)21(13-16)31(28,29)26-7-9-30-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,25,27)