ethyl 5-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N4O5S2 MolecularWeight: 492.61152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C22H28N4O5S2/c1-5-7-10-26-17-9-8-15(33(23,29)30)11-16(17)25-22(26)32-12-18(27)20-13(3)19(14(4)24-20)21(28)31-6-2/h8-9,11,24H,5-7,10,12H2,1-4H3,(H2,23,29,30)