N-(1-cyanocyclopentyl)-2-[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[[5-(diethylsulfamoyl)-1-ethyl-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[5-(diethylsulfamoyl)-1-ethylbenzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]thio]acetamide Formula: C21H29N5O3S2 MolecularWeight: 463.61666

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)NC3(CCCC3)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)NC3(CCCC3)C#N

InChI

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