[2-[[2-(diethylamino)-5-sulfamoyl-phenyl]amino]-2-oxidanylidene-ethyl] 1-methylpyrrole-2-carboxylate

Systemtic Name: [2-[[2-(diethylamino)-5-sulfamoyl-phenyl]amino]-2-oxidanylidene-ethyl] 1-methylpyrrole-2-carboxylate Openeye Name: [2-[2-(diethylamino)-5-sulfamoyl-anilino]-2-oxo-ethyl] 1-methylpyrrole-2-carboxylate CAS Name: 1-methyl-2-pyrrolecarboxylic acid [2-[2-(diethylamino)-5-sulfamoylanilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(diethylamino)-5-sulfamoylanilino]-2-oxoethyl] 1-methylpyrrole-2-carboxylate Traditional Name: 1-methylpyrrole-2-carboxylic acid [2-[2-(diethylamino)-5-sulfamoyl-anilino]-2-keto-ethyl] ester Formula: C18H24N4O5S MolecularWeight: 408.47196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)COC(=O)C2=CC=CN2C

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N)NC(=O)COC(=O)C2=CC=CN2C

InChI

InChI=1S/C18H24N4O5S/c1-4-22(5-2)15-9-8-13(28(19,25)26)11-14(15)20-17(23)12-27-18(24)16-7-6-10-21(16)3/h6-11H,4-5,12H2,1-3H3,(H,20,23)(H2,19,25,26)