5-chloranyl-6-[cyano-(4-methylphenyl)sulfonyl-methylidene]-1H-pyrazine-2,3-dicarbonitrile

Systemtic Name: 5-chloranyl-6-[cyano-(4-methylphenyl)sulfonyl-methylidene]-1H-pyrazine-2,3-dicarbonitrile Openeye Name: 5-chloro-6-[cyano(p-tolylsulfonyl)methylene]-1H-pyrazine-2,3-dicarbonitrile CAS Name: 5-chloro-6-[cyano-(4-methylphenyl)sulfonylmethylidene]-1H-pyrazine-2,3-dicarbonitrile IUPAC Name: 5-chloro-6-[cyano-(4-methylphenyl)sulfonylmethylidene]-1H-pyrazine-2,3-dicarbonitrile Traditional Name: 5-chloro-6-[cyano(tosyl)methylene]-1H-pyrazine-2,3-dicarbonitrile Formula: C15H8ClN5O2S MolecularWeight: 357.77432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C2C(=NC(=C(N2)C#N)C#N)Cl)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=C2C(=NC(=C(N2)C#N)C#N)Cl)C#N

InChI

InChI=1S/C15H8ClN5O2S/c1-9-2-4-10(5-3-9)24(22,23)13(8-19)14-15(16)21-12(7-18)11(6-17)20-14/h2-5,20H,1H3