4-[(3-fluoranyl-4-methyl-phenyl)amino]-7-(4-methylsulfonylphenyl)quinoline-3-carboxamide

Systemtic Name: 4-[(3-fluoranyl-4-methyl-phenyl)amino]-7-(4-methylsulfonylphenyl)quinoline-3-carboxamide Openeye Name: 4-(3-fluoro-4-methyl-anilino)-7-(4-methylsulfonylphenyl)quinoline-3-carboxamide CAS Name: 4-(3-fluoro-4-methylanilino)-7-(4-methylsulfonylphenyl)-3-quinolinecarboxamide IUPAC Name: 4-(3-fluoro-4-methylanilino)-7-(4-methylsulfonylphenyl)quinoline-3-carboxamide Traditional Name: 4-(3-fluoro-4-methyl-anilino)-7-(4-mesylphenyl)quinoline-3-carboxamide Formula: C24H20FN3O3S MolecularWeight: 449.497303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)N)C4=CC=C(C=C4)S(=O)(=O)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C(=O)N)C4=CC=C(C=C4)S(=O)(=O)C)F

InChI

InChI=1S/C24H20FN3O3S/c1-14-3-7-17(12-21(14)25)28-23-19-10-6-16(11-22(19)27-13-20(23)24(26)29)15-4-8-18(9-5-15)32(2,30)31/h3-13H,1-2H3,(H2,26,29)(H,27,28)