3-[2-(2-cyanoethylsulfanyl)benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-(2-cyanoethylsulfanyl)benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-(2-cyanoethylsulfanyl)benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-(2-cyanoethylthio)-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-(2-cyanoethylsulfanyl)benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-(2-cyanoethylthio)benzimidazol-1-yl]propionitrile Formula: C13H12N4S MolecularWeight: 256.32618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCCC#N

InChI

InChI=1S/C13H12N4S/c14-7-3-9-17-12-6-2-1-5-11(12)16-13(17)18-10-4-8-15/h1-2,5-6H,3-4,9-10H2