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

Systemtic Name: 3-(furan-2-ylmethylamino)-5-sulfamoyl-4-thiophen-2-yl-benzoic acid Openeye Name: 3-(2-furylmethylamino)-5-sulfamoyl-4-(2-thienyl)benzoic acid CAS Name: 3-(2-furanylmethylamino)-5-sulfamoyl-4-thiophen-2-ylbenzoic acid IUPAC Name: 3-(furan-2-ylmethylamino)-5-sulfamoyl-4-thiophen-2-ylbenzoic acid Traditional Name: 3-(2-furfurylamino)-5-sulfamoyl-4-(2-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=CC=CS3

Isomeric SMILES

C1=COC(=C1)CNC2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)C3=CC=CS3

InChI

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