ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[2-[4-(phenylsulfamoyl)phenyl]carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[2-[4-(phenylsulfamoyl)phenyl]carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[4-(phenylsulfamoyl)benzoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[1-oxo-2-[oxo-[4-(phenylsulfamoyl)phenyl]methoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[4-(phenylsulfamoyl)benzoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-[4-(phenylsulfamoyl)benzoyl]oxyacetyl]amino]-4-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C31H28N2O9S2 MolecularWeight: 636.69202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)NC(=O)COC(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)NC(=O)COC(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

InChI

InChI=1S/C31H28N2O9S2/c1-3-39-31(36)28-24(15-20-9-14-25-26(16-20)42-18-41-25)19(2)43-29(28)32-27(34)17-40-30(35)21-10-12-23(13-11-21)44(37,38)33-22-7-5-4-6-8-22/h4-14,16,33H,3,15,17-18H2,1-2H3,(H,32,34)