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

Systemtic Name: methyl 2-(azocan-1-ylsulfonyl)-6-cyclopentylcarbonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 2-(azocan-1-ylsulfonyl)-6-(cyclopentanecarbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-(1-azocanylsulfonyl)-6-[cyclopentyl(oxo)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(azocan-1-ylsulfonyl)-6-(cyclopentanecarbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 2-(azocan-1-ylsulfonyl)-6-(cyclopentanecarbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C22H32N2O5S2 MolecularWeight: 468.62988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3CCCC3)S(=O)(=O)N4CCCCCCC4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3CCCC3)S(=O)(=O)N4CCCCCCC4

InChI

InChI=1S/C22H32N2O5S2/c1-29-21(26)19-17-11-14-23(20(25)16-9-5-6-10-16)15-18(17)30-22(19)31(27,28)24-12-7-3-2-4-8-13-24/h16H,2-15H2,1H3