8-ethyl-4-[(4-fluoranyl-3-methoxy-phenyl)amino]-6-methylsulfonyl-quinoline-3-carboxamide

Systemtic Name: 8-ethyl-4-[(4-fluoranyl-3-methoxy-phenyl)amino]-6-methylsulfonyl-quinoline-3-carboxamide Openeye Name: 8-ethyl-4-(4-fluoro-3-methoxy-anilino)-6-methylsulfonyl-quinoline-3-carboxamide CAS Name: 8-ethyl-4-(4-fluoro-3-methoxyanilino)-6-methylsulfonyl-3-quinolinecarboxamide IUPAC Name: 8-ethyl-4-(4-fluoro-3-methoxyanilino)-6-methylsulfonylquinoline-3-carboxamide Traditional Name: 8-ethyl-4-(4-fluoro-3-methoxy-anilino)-6-mesyl-quinoline-3-carboxamide Formula: C20H20FN3O4S MolecularWeight: 417.453903

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(C=N2)C(=O)N)NC3=CC(=C(C=C3)F)OC

Isomeric SMILES

CCC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(C=N2)C(=O)N)NC3=CC(=C(C=C3)F)OC

InChI

InChI=1S/C20H20FN3O4S/c1-4-11-7-13(29(3,26)27)9-14-18(11)23-10-15(20(22)25)19(14)24-12-5-6-16(21)17(8-12)28-2/h5-10H,4H2,1-3H3,(H2,22,25)(H,23,24)