methyl 6-[(Z)-2-fluoranyl-3-phenyl-prop-2-enoyl]-2-piperidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 6-[(Z)-2-fluoranyl-3-phenyl-prop-2-enoyl]-2-piperidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-[(Z)-2-fluoro-3-phenyl-prop-2-enoyl]-2-(1-piperidylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-[(Z)-2-fluoro-1-oxo-3-phenylprop-2-enyl]-2-(1-piperidinylsulfonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[(Z)-2-fluoro-3-phenylprop-2-enoyl]-2-piperidin-1-ylsulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-[(Z)-2-fluoro-3-phenyl-acryloyl]-2-piperidinosulfonyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C23H25FN2O5S2 MolecularWeight: 492.583403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCN(C2)C(=O)C(=CC3=CC=CC=C3)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

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

InChI

InChI=1S/C23H25FN2O5S2/c1-31-22(28)20-17-10-13-25(21(27)18(24)14-16-8-4-2-5-9-16)15-19(17)32-23(20)33(29,30)26-11-6-3-7-12-26/h2,4-5,8-9,14H,3,6-7,10-13,15H2,1H3/b18-14-