methyl 2-pyrrolidin-1-ylsulfonyl-6-quinoxalin-6-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-pyrrolidin-1-ylsulfonyl-6-quinoxalin-6-ylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-pyrrolidin-1-ylsulfonyl-6-(quinoxaline-6-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-[oxo(6-quinoxalinyl)methyl]-2-(1-pyrrolidinylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-pyrrolidin-1-ylsulfonyl-6-(quinoxaline-6-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-pyrrolidinosulfonyl-6-(quinoxaline-6-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=CC4=NC=CN=C4C=C3)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C22H22N4O5S2/c1-31-21(28)19-15-6-11-25(20(27)14-4-5-16-17(12-14)24-8-7-23-16)13-18(15)32-22(19)33(29,30)26-9-2-3-10-26/h4-5,7-8,12H,2-3,6,9-11,13H2,1H3