2-(3-chloranylpyrazin-2-yl)-2-(4-methylphenyl)sulfonyl-ethanenitrile

Systemtic Name: 2-(3-chloranylpyrazin-2-yl)-2-(4-methylphenyl)sulfonyl-ethanenitrile Openeye Name: 2-(3-chloropyrazin-2-yl)-2-(p-tolylsulfonyl)acetonitrile CAS Name: 2-(3-chloro-2-pyrazinyl)-2-(4-methylphenyl)sulfonylacetonitrile IUPAC Name: 2-(3-chloropyrazin-2-yl)-2-(4-methylphenyl)sulfonylacetonitrile Traditional Name: 2-(3-chloropyrazin-2-yl)-2-tosyl-acetonitrile Formula: C13H10ClN3O2S MolecularWeight: 307.7554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC=CN=C2Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC=CN=C2Cl

InChI

InChI=1S/C13H10ClN3O2S/c1-9-2-4-10(5-3-9)20(18,19)11(8-15)12-13(14)17-7-6-16-12/h2-7,11H,1H3