4-[(4-fluoranyl-3-methoxy-phenyl)amino]-8-methyl-6-morpholin-4-ylsulfonyl-quinoline-3-carboxamide

Systemtic Name: 4-[(4-fluoranyl-3-methoxy-phenyl)amino]-8-methyl-6-morpholin-4-ylsulfonyl-quinoline-3-carboxamide Openeye Name: 4-(4-fluoro-3-methoxy-anilino)-8-methyl-6-morpholinosulfonyl-quinoline-3-carboxamide CAS Name: 4-(4-fluoro-3-methoxyanilino)-8-methyl-6-(4-morpholinylsulfonyl)-3-quinolinecarboxamide IUPAC Name: 4-(4-fluoro-3-methoxyanilino)-8-methyl-6-morpholin-4-ylsulfonylquinoline-3-carboxamide Traditional Name: 4-(4-fluoro-3-methoxy-anilino)-8-methyl-6-morpholinosulfonyl-quinoline-3-carboxamide Formula: C22H23FN4O5S MolecularWeight: 474.505223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)N3CCOCC3)C(=C(C=N2)C(=O)N)NC4=CC(=C(C=C4)F)OC

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)N3CCOCC3)C(=C(C=N2)C(=O)N)NC4=CC(=C(C=C4)F)OC

InChI

InChI=1S/C22H23FN4O5S/c1-13-9-15(33(29,30)27-5-7-32-8-6-27)11-16-20(13)25-12-17(22(24)28)21(16)26-14-3-4-18(23)19(10-14)31-2/h3-4,9-12H,5-8H2,1-2H3,(H2,24,28)(H,25,26)