methyl 3-[[4-chloranyl-2-(phenethylcarbamoyl)phenyl]-methyl-sulfamoyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-chloranyl-2-(phenethylcarbamoyl)phenyl]-methyl-sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[[4-chloro-2-(phenethylcarbamoyl)phenyl]-methyl-sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[4-chloro-2-[oxo-(phenethylamino)methyl]phenyl]-methylsulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-chloro-2-(phenethylcarbamoyl)phenyl]-methylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[4-chloro-2-(phenethylcarbamoyl)phenyl]-methyl-sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C22H21ClN2O5S2 MolecularWeight: 492.99554

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

Isomeric SMILES

CN(C1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C22H21ClN2O5S2/c1-25(32(28,29)19-11-13-31-20(19)22(27)30-2)18-9-8-16(23)14-17(18)21(26)24-12-10-15-6-4-3-5-7-15/h3-9,11,13-14H,10,12H2,1-2H3,(H,24,26)