2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanenitrile Openeye Name: 2-[1-(o-tolyl)imidazol-2-yl]sulfanylacetonitrile CAS Name: 2-[[1-(2-methylphenyl)-2-imidazolyl]thio]acetonitrile IUPAC Name: 2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetonitrile Traditional Name: 2-[[1-(o-tolyl)imidazol-2-yl]thio]acetonitrile Formula: C12H11N3S MolecularWeight: 229.30084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC#N

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC#N

InChI

InChI=1S/C12H11N3S/c1-10-4-2-3-5-11(10)15-8-7-14-12(15)16-9-6-13/h2-5,7-8H,9H2,1H3