potassium 4-(2-methylpropylsulfonyl)-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonate

Systemtic Name: potassium 4-(2-methylpropylsulfonyl)-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonate Openeye Name: potassium 4-isobutylsulfonyl-5-sulfamoyl-2-(2-thienylmethylamino)benzenesulfonate CAS Name: potassium 4-(2-methylpropylsulfonyl)-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonate IUPAC Name: potassium 4-(2-methylpropylsulfonyl)-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonate Traditional Name: potassium 4-isobutylsulfonyl-5-sulfamoyl-2-(2-thenylamino)besylate Formula: C15H19KN2O7S4 MolecularWeight: 506.67886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=C(C=C(C(=C1)NCC2=CC=CS2)S(=O)(=O)[O-])S(=O)(=O)N.[K+]

Isomeric SMILES

CC(C)CS(=O)(=O)C1=C(C=C(C(=C1)NCC2=CC=CS2)S(=O)(=O)[O-])S(=O)(=O)N.[K+]

InChI

InChI=1S/C15H20N2O7S4.K/c1-10(2)9-26(18,19)14-6-12(17-8-11-4-3-5-25-11)13(28(22,23)24)7-15(14)27(16,20)21;/h3-7,10,17H,8-9H2,1-2H3,(H2,16,20,21)(H,22,23,24);/q;+1/p-1