2-(3-cyanopropylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-(3-cyanopropylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide Openeye Name: 2-(3-cyanopropylsulfanyl)-1-ethyl-benzimidazole-5-sulfonamide CAS Name: 2-(3-cyanopropylthio)-1-ethyl-5-benzimidazolesulfonamide IUPAC Name: 2-(3-cyanopropylsulfanyl)-1-ethylbenzimidazole-5-sulfonamide Traditional Name: 2-(3-cyanopropylthio)-1-ethyl-benzimidazole-5-sulfonamide Formula: C13H16N4O2S2 MolecularWeight: 324.42174

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCCC#N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCCCC#N

InChI

InChI=1S/C13H16N4O2S2/c1-2-17-12-6-5-10(21(15,18)19)9-11(12)16-13(17)20-8-4-3-7-14/h5-6,9H,2-4,8H2,1H3,(H2,15,18,19)