5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methylthiophene-2-carboxylic acid Traditional Name: 5-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-3-methyl-2-thenoic acid Formula: C13H13NO4S3 MolecularWeight: 343.44162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)N2CCC3=C(C2)C=CS3)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)N2CCC3=C(C2)C=CS3)C(=O)O

InChI

InChI=1S/C13H13NO4S3/c1-8-6-11(20-12(8)13(15)16)21(17,18)14-4-2-10-9(7-14)3-5-19-10/h3,5-6H,2,4,7H2,1H3,(H,15,16)