3-[(3-methylpyridin-2-yl)sulfonylamino]-5-(2-phenylethynyl)thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-methylpyridin-2-yl)sulfonylamino]-5-(2-phenylethynyl)thiophene-2-carboxylic acid Openeye Name: 3-[(3-methyl-2-pyridyl)sulfonylamino]-5-(2-phenylethynyl)thiophene-2-carboxylic acid CAS Name: 3-[(3-methyl-2-pyridinyl)sulfonylamino]-5-(2-phenylethynyl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(3-methylpyridin-2-yl)sulfonylamino]-5-(2-phenylethynyl)thiophene-2-carboxylic acid Traditional Name: 3-[(3-methyl-2-pyridyl)sulfonylamino]-5-(2-phenylethynyl)-2-thenoic acid Formula: C19H14N2O4S2 MolecularWeight: 398.45546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)S(=O)(=O)NC2=C(SC(=C2)C#CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(N=CC=C1)S(=O)(=O)NC2=C(SC(=C2)C#CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H14N2O4S2/c1-13-6-5-11-20-18(13)27(24,25)21-16-12-15(26-17(16)19(22)23)10-9-14-7-3-2-4-8-14/h2-8,11-12,21H,1H3,(H,22,23)