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

Systemtic Name: 5-bromanyl-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)thiophene-2-carboxylic acid Openeye Name: 5-bromo-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)thiophene-2-carboxylic acid CAS Name: 5-bromo-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)thiophene-2-carboxylic acid Traditional Name: 5-bromo-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-2-thenoic acid Formula: C12H10BrNO4S3 MolecularWeight: 408.3111

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=C(SC(=C3)C(=O)O)Br

Isomeric SMILES

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=C(SC(=C3)C(=O)O)Br

InChI

InChI=1S/C12H10BrNO4S3/c13-11-10(5-9(20-11)12(15)16)21(17,18)14-3-1-8-7(6-14)2-4-19-8/h2,4-5H,1,3,6H2,(H,15,16)