2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanamide Openeye Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]acetamide Formula: C12H12N4OS MolecularWeight: 260.31488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)N

InChI

InChI=1S/C12H12N4OS/c13-6-3-7-16-10-5-2-1-4-9(10)15-12(16)18-8-11(14)17/h1-2,4-5H,3,7-8H2,(H2,14,17)