4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-8-methyl-6-methylsulfonyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-2-fluoranyl-phenyl)amino]-8-methyl-6-methylsulfonyl-quinoline-3-carboxamide Openeye Name: 4-(3-chloro-2-fluoro-anilino)-8-methyl-6-methylsulfonyl-quinoline-3-carboxamide CAS Name: 4-(3-chloro-2-fluoroanilino)-8-methyl-6-methylsulfonyl-3-quinolinecarboxamide IUPAC Name: 4-(3-chloro-2-fluoroanilino)-8-methyl-6-methylsulfonylquinoline-3-carboxamide Traditional Name: 4-(3-chloro-2-fluoro-anilino)-6-mesyl-8-methyl-quinoline-3-carboxamide Formula: C18H15ClFN3O3S MolecularWeight: 407.846403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(C=N2)C(=O)N)NC3=C(C(=CC=C3)Cl)F

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)C)C(=C(C=N2)C(=O)N)NC3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C18H15ClFN3O3S/c1-9-6-10(27(2,25)26)7-11-16(9)22-8-12(18(21)24)17(11)23-14-5-3-4-13(19)15(14)20/h3-8H,1-2H3,(H2,21,24)(H,22,23)