5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[(3-chloro-2-methylphenyl)sulfonylamino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(3-chloro-2-methylphenyl)sulfonylamino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-3-methyl-2-thenoic acid Formula: C13H12ClNO4S2 MolecularWeight: 345.82168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NS(=O)(=O)C2=C(C(=CC=C2)Cl)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NS(=O)(=O)C2=C(C(=CC=C2)Cl)C)C(=O)O

InChI

InChI=1S/C13H12ClNO4S2/c1-7-6-11(20-12(7)13(16)17)15-21(18,19)10-5-3-4-9(14)8(10)2/h3-6,15H,1-2H3,(H,16,17)