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

Systemtic Name: 2-(cyanomethylsulfanyl)-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-(cyanomethylsulfanyl)-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-(cyanomethylthio)-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-(cyanomethylsulfanyl)-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-(cyanomethylthio)-1-propyl-benzimidazole-5-sulfonamide Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC#N

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC#N

InChI

InChI=1S/C12H14N4O2S2/c1-2-6-16-11-4-3-9(20(14,17)18)8-10(11)15-12(16)19-7-5-13/h3-4,8H,2,6-7H2,1H3,(H2,14,17,18)