4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylsulfonyl)-1H-pyrrole-2-carboxylic acid Formula: C12H12N2O4S2 MolecularWeight: 312.36468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=CNC(=C3)C(=O)O

Isomeric SMILES

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=CNC(=C3)C(=O)O

InChI

InChI=1S/C12H12N2O4S2/c15-12(16)10-5-9(6-13-10)20(17,18)14-3-1-11-8(7-14)2-4-19-11/h2,4-6,13H,1,3,7H2,(H,15,16)