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

Systemtic Name: methyl 6-(2-methylphenyl)carbonyl-2-(phenethylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Openeye Name: methyl 6-(2-methylbenzoyl)-2-(phenethylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate CAS Name: 6-[(2-methylphenyl)-oxomethyl]-2-(phenethylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(2-methylbenzoyl)-2-(phenethylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate Traditional Name: 6-o-toluoyl-2-(phenethylsulfamoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid methyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC3=C(C2)SC(=C3C(=O)OC)S(=O)(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC3=C(C2)SC(=C3C(=O)OC)S(=O)(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5S2/c1-17-8-6-7-11-19(17)23(28)27-15-13-20-21(16-27)33-25(22(20)24(29)32-2)34(30,31)26-14-12-18-9-4-3-5-10-18/h3-11,26H,12-16H2,1-2H3