3-[(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-ethoxycarbonyl-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-carbethoxy-2,5-dimethyl-1H-pyrrol-3-yl)sulfonylamino]-5-phenyl-2-thenoic acid Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O)C)C

InChI

InChI=1S/C20H20N2O6S2/c1-4-28-20(25)16-11(2)21-12(3)18(16)30(26,27)22-14-10-15(29-17(14)19(23)24)13-8-6-5-7-9-13/h5-10,21-22H,4H2,1-3H3,(H,23,24)