N-[2-(butylamino)-5-sulfamoyl-phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[2-(butylamino)-5-sulfamoyl-phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[2-(butylamino)-5-sulfamoyl-phenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[2-(butylamino)-5-sulfamoylphenyl]-2-(3,4,5-trimethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(butylamino)-5-sulfamoylphenyl]-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[2-(butylamino)-5-sulfamoyl-phenyl]-2-(3,4,5-trimethoxyphenyl)cinchoninamide Formula: C29H32N4O6S MolecularWeight: 564.65258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C29H32N4O6S/c1-5-6-13-31-23-12-11-19(40(30,35)36)16-25(23)33-29(34)21-17-24(32-22-10-8-7-9-20(21)22)18-14-26(37-2)28(39-4)27(15-18)38-3/h7-12,14-17,31H,5-6,13H2,1-4H3,(H,33,34)(H2,30,35,36)