4-[carboxy-(5-phenylthiophen-3-yl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-[carboxy-(5-phenylthiophen-3-yl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid Openeye Name: 4-[carboxy-(5-phenyl-3-thienyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid CAS Name: 4-[carboxy-(5-phenyl-3-thiophenyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-[carboxy-(5-phenylthiophen-3-yl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid Traditional Name: 4-[carboxy-(5-phenyl-3-thienyl)sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid Formula: C18H16N2O6S2 MolecularWeight: 420.45944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)S(=O)(=O)N(C2=CSC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=C(N1)C)S(=O)(=O)N(C2=CSC(=C2)C3=CC=CC=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C18H16N2O6S2/c1-10-15(17(21)22)16(11(2)19-10)28(25,26)20(18(23)24)13-8-14(27-9-13)12-6-4-3-5-7-12/h3-9,19H,1-2H3,(H,21,22)(H,23,24)