4-(2-methylsulfanylbenzimidazol-1-yl)butanenitrile

Systemtic Name: 4-(2-methylsulfanylbenzimidazol-1-yl)butanenitrile Openeye Name: 4-(2-methylsulfanylbenzimidazol-1-yl)butanenitrile CAS Name: 4-[2-(methylthio)-1-benzimidazolyl]butanenitrile IUPAC Name: 4-(2-methylsulfanylbenzimidazol-1-yl)butanenitrile Traditional Name: 4-[2-(methylthio)benzimidazol-1-yl]butyronitrile Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=CC=C2N1CCCC#N

Isomeric SMILES

CSC1=NC2=CC=CC=C2N1CCCC#N

InChI

InChI=1S/C12H13N3S/c1-16-12-14-10-6-2-3-7-11(10)15(12)9-5-4-8-13/h2-3,6-7H,4-5,9H2,1H3