ethyl (2Z)-2-cyano-2-[4-(phenylsulfonyl)-1,3-dithiol-2-ylidene]ethanoate

Systemtic Name: ethyl (2Z)-2-cyano-2-[4-(phenylsulfonyl)-1,3-dithiol-2-ylidene]ethanoate Openeye Name: ethyl (2Z)-2-[4-(benzenesulfonyl)-1,3-dithiol-2-ylidene]-2-cyano-acetate CAS Name: (2Z)-2-[4-(benzenesulfonyl)-1,3-dithiol-2-ylidene]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[4-(benzenesulfonyl)-1,3-dithiol-2-ylidene]-2-cyanoacetate Traditional Name: (2Z)-2-(4-besyl-1,3-dithiol-2-ylidene)-2-cyano-acetic acid ethyl ester Formula: C14H11NO4S3 MolecularWeight: 353.43644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SC=C(S1)S(=O)(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C\1/SC=C(S1)S(=O)(=O)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C14H11NO4S3/c1-2-19-13(16)11(8-15)14-20-9-12(21-14)22(17,18)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3/b14-11-