1-butyl-2-(cyanomethylsulfanyl)benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-(cyanomethylsulfanyl)benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-(cyanomethylsulfanyl)benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-(cyanomethylthio)-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-(cyanomethylsulfanyl)benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-(cyanomethylthio)benzimidazole-5-sulfonamide Formula: C13H16N4O2S2 MolecularWeight: 324.42174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O2S2/c1-2-3-7-17-12-5-4-10(21(15,18)19)9-11(12)16-13(17)20-8-6-14/h4-5,9H,2-3,7-8H2,1H3,(H2,15,18,19)