2-cyano-2-methylsulfonyl-2-(4-nitrophenyl)ethanethioamide

Systemtic Name: 2-cyano-2-methylsulfonyl-2-(4-nitrophenyl)ethanethioamide Openeye Name: 2-cyano-2-methylsulfonyl-2-(4-nitrophenyl)thioacetamide CAS Name: 2-cyano-2-methylsulfonyl-2-(4-nitrophenyl)ethanethioamide IUPAC Name: 2-cyano-2-methylsulfonyl-2-(4-nitrophenyl)ethanethioamide Traditional Name: 2-cyano-2-mesyl-2-(4-nitrophenyl)thioacetamide Formula: C10H9N3O4S2 MolecularWeight: 299.32616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(C#N)(C1=CC=C(C=C1)[N+](=O)[O-])C(=S)N

Isomeric SMILES

CS(=O)(=O)C(C#N)(C1=CC=C(C=C1)[N+](=O)[O-])C(=S)N

InChI

InChI=1S/C10H9N3O4S2/c1-19(16,17)10(6-11,9(12)18)7-2-4-8(5-3-7)13(14)15/h2-5H,1H3,(H2,12,18)