2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-4-carboxamide CAS Name: 2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(4-methoxyphenyl)-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]cinchoninamide Formula: C29H28N4O4S MolecularWeight: 528.62202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)S(=O)(=O)NC5=NCCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)S(=O)(=O)NC5=NCCCCC5

InChI

InChI=1S/C29H28N4O4S/c1-37-22-15-13-20(14-16-22)27-19-25(24-10-4-5-11-26(24)32-27)29(34)31-21-8-7-9-23(18-21)38(35,36)33-28-12-3-2-6-17-30-28/h4-5,7-11,13-16,18-19H,2-3,6,12,17H2,1H3,(H,30,33)(H,31,34)