2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanylethanenitrile

Systemtic Name: 2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanylethanenitrile Openeye Name: 2-[6-(p-tolyl)pyridazin-3-yl]sulfanylacetonitrile CAS Name: 2-[[6-(4-methylphenyl)-3-pyridazinyl]thio]acetonitrile IUPAC Name: 2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanylacetonitrile Traditional Name: 2-[[6-(p-tolyl)pyridazin-3-yl]thio]acetonitrile Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC#N

InChI

InChI=1S/C13H11N3S/c1-10-2-4-11(5-3-10)12-6-7-13(16-15-12)17-9-8-14/h2-7H,9H2,1H3