2-(4-ethoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-N-[4-(p-tolylsulfonylamino)phenyl]quinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide Traditional Name: 2-p-phenetyl-N-[4-(tosylamino)phenyl]cinchoninamide Formula: C31H27N3O4S MolecularWeight: 537.62878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C31H27N3O4S/c1-3-38-25-16-10-22(11-17-25)30-20-28(27-6-4-5-7-29(27)33-30)31(35)32-23-12-14-24(15-13-23)34-39(36,37)26-18-8-21(2)9-19-26/h4-20,34H,3H2,1-2H3,(H,32,35)