3-(furan-2-ylmethylamino)-5-sulfamoyl-4-thiophen-3-yl-benzoic acid

Systemtic Name: 3-(furan-2-ylmethylamino)-5-sulfamoyl-4-thiophen-3-yl-benzoic acid Openeye Name: 3-(2-furylmethylamino)-5-sulfamoyl-4-(3-thienyl)benzoic acid CAS Name: 3-(2-furanylmethylamino)-5-sulfamoyl-4-(3-thiophenyl)benzoic acid IUPAC Name: 3-(furan-2-ylmethylamino)-5-sulfamoyl-4-thiophen-3-ylbenzoic acid Traditional Name: 3-(2-furfurylamino)-5-sulfamoyl-4-(3-thienyl)benzoic acid Formula: C16H14N2O5S2 MolecularWeight: 378.42276

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)C3=CSC=C3

Isomeric SMILES

C1=COC(=C1)CNC2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)C3=CSC=C3

InChI

InChI=1S/C16H14N2O5S2/c17-25(21,22)14-7-11(16(19)20)6-13(15(14)10-3-5-24-9-10)18-8-12-2-1-4-23-12/h1-7,9,18H,8H2,(H,19,20)(H2,17,21,22)