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

Systemtic Name: 2-(2,4-dimethylphenyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-[[4-(methylsulfamoylmethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-[4-(methylsulfamoylmethyl)benzyl]cinchoninamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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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=C(C=C4)CS(=O)(=O)NC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)CS(=O)(=O)NC)C

InChI

InChI=1S/C27H27N3O3S/c1-18-8-13-22(19(2)14-18)26-15-24(23-6-4-5-7-25(23)30-26)27(31)29-16-20-9-11-21(12-10-20)17-34(32,33)28-3/h4-15,28H,16-17H2,1-3H3,(H,29,31)