6-(butylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-(butylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-(butylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-(butylsulfamoyl)-N-[2-(1-cyclohexenyl)ethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-(butylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-(butylsulfamoyl)-N-[2-(cyclohexen-1-yl)ethyl]-2-(3-pyridyl)cinchoninamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CCCCC3)C4=CN=CC=C4

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCCC3=CCCCC3)C4=CN=CC=C4

InChI

InChI=1S/C27H32N4O3S/c1-2-3-15-30-35(33,34)22-11-12-25-23(17-22)24(18-26(31-25)21-10-7-14-28-19-21)27(32)29-16-13-20-8-5-4-6-9-20/h7-8,10-12,14,17-19,30H,2-6,9,13,15-16H2,1H3,(H,29,32)