N-(1-cyanocyclohexyl)-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C18H23N5O3S2 MolecularWeight: 421.53692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3(CCCCC3)C#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3(CCCCC3)C#N

InChI

InChI=1S/C18H23N5O3S2/c1-2-23-15-7-6-13(28(20,25)26)10-14(15)21-17(23)27-11-16(24)22-18(12-19)8-4-3-5-9-18/h6-7,10H,2-5,8-9,11H2,1H3,(H,22,24)(H2,20,25,26)