methyl 6-ethyl-2-[2-(4-methylphenyl)sulfonylethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 6-ethyl-2-[2-(4-methylphenyl)sulfonylethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-ethyl-2-[[2-(p-tolylsulfonyl)acetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-ethyl-2-[[2-(4-methylphenyl)sulfonyl-1-oxoethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-ethyl-2-[[2-(4-methylphenyl)sulfonylacetyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-ethyl-2-[(2-tosylacetyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H24N2O5S2/c1-4-22-10-9-15-16(11-22)28-19(18(15)20(24)27-3)21-17(23)12-29(25,26)14-7-5-13(2)6-8-14/h5-8H,4,9-12H2,1-3H3,(H,21,23)