2-(2,4-dimethylphenyl)-N-[[2-(methylsulfonylamino)phenyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-N-[[2-(methylsulfonylamino)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-[[2-(methanesulfonamido)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-[2-(methanesulfonamido)benzyl]cinchoninamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4NS(=O)(=O)C)C

InChI

InChI=1S/C26H25N3O3S/c1-17-12-13-20(18(2)14-17)25-15-22(21-9-5-7-11-24(21)28-25)26(30)27-16-19-8-4-6-10-23(19)29-33(3,31)32/h4-15,29H,16H2,1-3H3,(H,27,30)