6-(butylsulfamoyl)-2-thiophen-2-yl-quinoline-4-carboxylate

Systemtic Name: 6-(butylsulfamoyl)-2-thiophen-2-yl-quinoline-4-carboxylate Openeye Name: 6-(butylsulfamoyl)-2-(2-thienyl)quinoline-4-carboxylate CAS Name: 6-(butylsulfamoyl)-2-thiophen-2-yl-4-quinolinecarboxylate IUPAC Name: 6-(butylsulfamoyl)-2-thiophen-2-ylquinoline-4-carboxylate Traditional Name: 6-(butylsulfamoyl)-2-(2-thienyl)cinchoninate Formula: C18H17N2O4S2- MolecularWeight: 389.46858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=CS3

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC=CS3

InChI

InChI=1S/C18H18N2O4S2/c1-2-3-8-19-26(23,24)12-6-7-15-13(10-12)14(18(21)22)11-16(20-15)17-5-4-9-25-17/h4-7,9-11,19H,2-3,8H2,1H3,(H,21,22)/p-1