2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(1-cyano-1-cyclopropyl-ethyl)ethanamide

Systemtic Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(1-cyano-1-cyclopropyl-ethyl)ethanamide Openeye Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(1-cyano-1-cyclopropyl-ethyl)acetamide CAS Name: 2-[[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]thio]-N-(1-cyano-1-cyclopropylethyl)acetamide IUPAC Name: 2-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]sulfanyl-N-(1-cyano-1-cyclopropylethyl)acetamide Traditional Name: 2-[[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]thio]-N-(1-cyano-1-cyclopropyl-ethyl)acetamide Formula: C21H29N5O3S2 MolecularWeight: 463.61666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)NC(C)(C#N)C3CC3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)NC(C)(C#N)C3CC3

InChI

InChI=1S/C21H29N5O3S2/c1-5-6-11-26-18-10-9-16(31(28,29)25(3)4)12-17(18)23-20(26)30-13-19(27)24-21(2,14-22)15-7-8-15/h9-10,12,15H,5-8,11,13H2,1-4H3,(H,24,27)