6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-(butylsulfamoyl)-N-[2-(4-chlorophenyl)ethyl]-2-(3-pyridyl)cinchoninamide Formula: C27H27ClN4O3S MolecularWeight: 523.04628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CC=C(C=C3)Cl)C4=CN=CC=C4

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CC=C(C=C3)Cl)C4=CN=CC=C4

InChI

InChI=1S/C27H27ClN4O3S/c1-2-3-14-31-36(34,35)22-10-11-25-23(16-22)24(17-26(32-25)20-5-4-13-29-18-20)27(33)30-15-12-19-6-8-21(28)9-7-19/h4-11,13,16-18,31H,2-3,12,14-15H2,1H3,(H,30,33)