N-(4-acetamidophenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetamidophenyl)-2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C21H25N5O4S2 MolecularWeight: 475.5843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H25N5O4S2/c1-3-4-11-26-19-10-9-17(32(22,29)30)12-18(19)25-21(26)31-13-20(28)24-16-7-5-15(6-8-16)23-14(2)27/h5-10,12H,3-4,11,13H2,1-2H3,(H,23,27)(H,24,28)(H2,22,29,30)