2-[imidazol-1-yl(methylsulfanyl)methyl]benzenecarbonitrile

Systemtic Name: 2-[imidazol-1-yl(methylsulfanyl)methyl]benzenecarbonitrile Openeye Name: 2-[imidazol-1-yl(methylsulfanyl)methyl]benzonitrile CAS Name: 2-[1-imidazolyl-(methylthio)methyl]benzonitrile IUPAC Name: 2-[imidazol-1-yl(methylsulfanyl)methyl]benzonitrile Traditional Name: 2-[imidazol-1-yl-(methylthio)methyl]benzonitrile Formula: C12H11N3S MolecularWeight: 229.30084

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C1=CC=CC=C1C#N)N2C=CN=C2

Isomeric SMILES

CSC(C1=CC=CC=C1C#N)N2C=CN=C2

InChI

InChI=1S/C12H11N3S/c1-16-12(15-7-6-14-9-15)11-5-3-2-4-10(11)8-13/h2-7,9,12H,1H3