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

Systemtic Name: ethyl 6-ethyl-2-[2-(4-methylphenyl)sulfonylethanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C21H26N2O5S2 MolecularWeight: 450.57154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S2/c1-4-23-11-10-16-17(12-23)29-20(19(16)21(25)28-5-2)22-18(24)13-30(26,27)15-8-6-14(3)7-9-15/h6-9H,4-5,10-13H2,1-3H3,(H,22,24)