2-(2-methylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(2-methylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(o-tolyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide CAS Name: 2-(2-methylphenyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-methylphenyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(o-tolyl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]cinchoninamide Formula: C27H21N5O3S MolecularWeight: 495.55234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C27H21N5O3S/c1-18-7-2-3-8-21(18)25-17-23(22-9-4-5-10-24(22)31-25)26(33)30-19-11-13-20(14-12-19)36(34,35)32-27-28-15-6-16-29-27/h2-17H,1H3,(H,30,33)(H,28,29,32)