5-(4-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-3-(p-tolylsulfonylamino)thiophene-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-3-(tosylamino)-2-thenoic acid Formula: C18H14ClNO4S2 MolecularWeight: 407.89106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H14ClNO4S2/c1-11-2-8-14(9-3-11)26(23,24)20-15-10-16(25-17(15)18(21)22)12-4-6-13(19)7-5-12/h2-10,20H,1H3,(H,21,22)