methyl 2-(butan-2-ylsulfamoyl)-6-(3-phenylpropanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate

Systemtic Name: methyl 2-(butan-2-ylsulfamoyl)-6-(3-phenylpropanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-(3-phenylpropanoyl)-2-(sec-butylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 2-(butan-2-ylsulfamoyl)-6-(1-oxo-3-phenylpropyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(butan-2-ylsulfamoyl)-6-(3-phenylpropanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-hydrocinnamoyl-2-(sec-butylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C22H28N2O5S2 MolecularWeight: 464.59812

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=C(C2=C(S1)CN(CC2)C(=O)CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=C(C2=C(S1)CN(CC2)C(=O)CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H28N2O5S2/c1-4-15(2)23-31(27,28)22-20(21(26)29-3)17-12-13-24(14-18(17)30-22)19(25)11-10-16-8-6-5-7-9-16/h5-9,15,23H,4,10-14H2,1-3H3