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

Systemtic Name: 4-[(4-fluoranyl-3-methoxy-phenyl)amino]-8-methoxy-6-methylsulfonyl-quinoline-3-carboxamide Openeye Name: 4-(4-fluoro-3-methoxy-anilino)-8-methoxy-6-methylsulfonyl-quinoline-3-carboxamide CAS Name: 4-(4-fluoro-3-methoxyanilino)-8-methoxy-6-methylsulfonyl-3-quinolinecarboxamide IUPAC Name: 4-(4-fluoro-3-methoxyanilino)-8-methoxy-6-methylsulfonylquinoline-3-carboxamide Traditional Name: 4-(4-fluoro-3-methoxy-anilino)-6-mesyl-8-methoxy-quinoline-3-carboxamide Formula: C19H18FN3O5S MolecularWeight: 419.426723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=C(C=NC3=C(C=C(C=C32)S(=O)(=O)C)OC)C(=O)N)F

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=C(C=NC3=C(C=C(C=C32)S(=O)(=O)C)OC)C(=O)N)F

InChI

InChI=1S/C19H18FN3O5S/c1-27-15-6-10(4-5-14(15)20)23-17-12-7-11(29(3,25)26)8-16(28-2)18(12)22-9-13(17)19(21)24/h4-9H,1-3H3,(H2,21,24)(H,22,23)