4-cycloheptylsulfonyl-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonic acid

Systemtic Name: 4-cycloheptylsulfonyl-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonic acid Openeye Name: 4-cycloheptylsulfonyl-5-sulfamoyl-2-(2-thienylmethylamino)benzenesulfonic acid CAS Name: 4-cycloheptylsulfonyl-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonic acid IUPAC Name: 4-cycloheptylsulfonyl-5-sulfamoyl-2-(thiophen-2-ylmethylamino)benzenesulfonic acid Traditional Name: 4-cycloheptylsulfonyl-5-sulfamoyl-2-(2-thenylamino)besylic acid Formula: C18H24N2O7S4 MolecularWeight: 508.65236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)S(=O)(=O)C2=C(C=C(C(=C2)NCC3=CC=CS3)S(=O)(=O)O)S(=O)(=O)N

Isomeric SMILES

C1CCCC(CC1)S(=O)(=O)C2=C(C=C(C(=C2)NCC3=CC=CS3)S(=O)(=O)O)S(=O)(=O)N

InChI

InChI=1S/C18H24N2O7S4/c19-30(23,24)18-11-16(31(25,26)27)15(20-12-13-6-5-9-28-13)10-17(18)29(21,22)14-7-3-1-2-4-8-14/h5-6,9-11,14,20H,1-4,7-8,12H2,(H2,19,23,24)(H,25,26,27)