5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Openeye Name: 5-(benzothiophen-2-yl)-3-(o-tolylsulfonylamino)thiophene-2-carboxylic acid CAS Name: 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]-2-thiophenecarboxylic acid IUPAC Name: 5-(1-benzothiophen-2-yl)-3-[(2-methylphenyl)sulfonylamino]thiophene-2-carboxylic acid Traditional Name: 5-(benzothiophen-2-yl)-3-(o-tolylsulfonylamino)-2-thenoic acid Formula: C20H15NO4S3 MolecularWeight: 429.5324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=C(SC(=C2)C3=CC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C20H15NO4S3/c1-12-6-2-5-9-18(12)28(24,25)21-14-11-17(27-19(14)20(22)23)16-10-13-7-3-4-8-15(13)26-16/h2-11,21H,1H3,(H,22,23)