methyl 2-(azocan-1-ylsulfonyl)-6-(oxolan-2-ylcarbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-(azocan-1-ylsulfonyl)-6-(oxolan-2-ylcarbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-(azocan-1-ylsulfonyl)-6-(tetrahydrofuran-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-(1-azocanylsulfonyl)-6-[oxo(2-oxolanyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(azocan-1-ylsulfonyl)-6-(oxolane-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-(azocan-1-ylsulfonyl)-6-(tetrahydrofuran-2-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C21H30N2O6S2 MolecularWeight: 470.6027

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3CCCO3)S(=O)(=O)N4CCCCCCC4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3CCCO3)S(=O)(=O)N4CCCCCCC4

InChI

InChI=1S/C21H30N2O6S2/c1-28-20(25)18-15-9-12-22(19(24)16-8-7-13-29-16)14-17(15)30-21(18)31(26,27)23-10-5-3-2-4-6-11-23/h16H,2-14H2,1H3