2-azanyl-2-dibenzofuran-2-ylsulfonyl-3-thiophen-2-ylcarbonyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 2-azanyl-2-dibenzofuran-2-ylsulfonyl-3-thiophen-2-ylcarbonyl-thiomorpholine-3-carboxylic acid Openeye Name: 2-amino-2-dibenzofuran-2-ylsulfonyl-3-(thiophene-2-carbonyl)thiomorpholine-3-carboxylic acid CAS Name: 2-amino-2-(2-dibenzofuranylsulfonyl)-3-[oxo(thiophen-2-yl)methyl]-3-thiomorpholinecarboxylic acid IUPAC Name: 2-amino-2-dibenzofuran-2-ylsulfonyl-3-(thiophene-2-carbonyl)thiomorpholine-3-carboxylic acid Traditional Name: 2-amino-2-dibenzofuran-2-ylsulfonyl-3-(2-thenoyl)thiomorpholine-3-carboxylic acid Formula: C22H18N2O6S3 MolecularWeight: 502.58312

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(C(N1)(C(=O)C2=CC=CS2)C(=O)O)(N)S(=O)(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

Isomeric SMILES

C1CSC(C(N1)(C(=O)C2=CC=CS2)C(=O)O)(N)S(=O)(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

InChI

InChI=1S/C22H18N2O6S3/c23-22(21(20(26)27,24-9-11-32-22)19(25)18-6-3-10-31-18)33(28,29)13-7-8-17-15(12-13)14-4-1-2-5-16(14)30-17/h1-8,10,12,24H,9,11,23H2,(H,26,27)