2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanylethanenitrile

Systemtic Name: 2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanylethanenitrile Openeye Name: 2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanylacetonitrile CAS Name: 2-[[6-(3-methoxyphenyl)-3-pyridazinyl]thio]acetonitrile IUPAC Name: 2-[6-(3-methoxyphenyl)pyridazin-3-yl]sulfanylacetonitrile Traditional Name: 2-[[6-(3-methoxyphenyl)pyridazin-3-yl]thio]acetonitrile Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(C=C2)SCC#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(C=C2)SCC#N

InChI

InChI=1S/C13H11N3OS/c1-17-11-4-2-3-10(9-11)12-5-6-13(16-15-12)18-8-7-14/h2-6,9H,8H2,1H3