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

Systemtic Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: 6-(butylsulfamoyl)-N-(p-tolylmethyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: 6-(butylsulfamoyl)-N-[(4-methylphenyl)methyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: 6-(butylsulfamoyl)-N-(4-methylbenzyl)-2-(2-thienyl)cinchoninamide Formula: C26H27N3O3S2 MolecularWeight: 493.64088

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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=CC=CS4

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)NCC3=CC=C(C=C3)C)C4=CC=CS4

InChI

InChI=1S/C26H27N3O3S2/c1-3-4-13-28-34(31,32)20-11-12-23-21(15-20)22(16-24(29-23)25-6-5-14-33-25)26(30)27-17-19-9-7-18(2)8-10-19/h5-12,14-16,28H,3-4,13,17H2,1-2H3,(H,27,30)