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

Systemtic Name: methyl 6-(3-fluorophenyl)carbonyl-2-piperidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-(3-fluorobenzoyl)-2-(1-piperidylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-[(3-fluorophenyl)-oxomethyl]-2-(1-piperidinylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-fluorobenzoyl)-2-piperidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-(3-fluorobenzoyl)-2-piperidinosulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C21H23FN2O5S2 MolecularWeight: 466.546123

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=CC(=CC=C3)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C3=CC(=CC=C3)F)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23FN2O5S2/c1-29-20(26)18-16-8-11-23(19(25)14-6-5-7-15(22)12-14)13-17(16)30-21(18)31(27,28)24-9-3-2-4-10-24/h5-7,12H,2-4,8-11,13H2,1H3