6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-(butylsulfamoyl)-N-(p-tolylmethyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-(butylsulfamoyl)-N-(4-methylbenzyl)-2-(3-pyridyl)cinchoninamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)C)C4=CN=CC=C4

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)C)C4=CN=CC=C4

InChI

InChI=1S/C27H28N4O3S/c1-3-4-14-30-35(33,34)22-11-12-25-23(15-22)24(16-26(31-25)21-6-5-13-28-18-21)27(32)29-17-20-9-7-19(2)8-10-20/h5-13,15-16,18,30H,3-4,14,17H2,1-2H3,(H,29,32)