3-[bis[(2-methylphenyl)sulfonyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 3-[bis[(2-methylphenyl)sulfonyl]amino]thiophene-2-carboxylic acid Openeye Name: 3-[bis(o-tolylsulfonyl)amino]thiophene-2-carboxylic acid CAS Name: 3-[bis[(2-methylphenyl)sulfonyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[bis[(2-methylphenyl)sulfonyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-[bis(o-tolylsulfonyl)amino]-2-thenoic acid Formula: C19H17NO6S3 MolecularWeight: 451.53638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N(C2=C(SC=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N(C2=C(SC=C2)C(=O)O)S(=O)(=O)C3=CC=CC=C3C

InChI

InChI=1S/C19H17NO6S3/c1-13-7-3-5-9-16(13)28(23,24)20(15-11-12-27-18(15)19(21)22)29(25,26)17-10-6-4-8-14(17)2/h3-12H,1-2H3,(H,21,22)