3-(cyanomethylsulfanyl)-2-methylsulfonyl-3-sulfanyl-propanenitrile

Systemtic Name: 3-(cyanomethylsulfanyl)-2-methylsulfonyl-3-sulfanyl-propanenitrile Openeye Name: 3-(cyanomethylsulfanyl)-2-methylsulfonyl-3-sulfanyl-propanenitrile CAS Name: 3-(cyanomethylthio)-3-mercapto-2-methylsulfonylpropanenitrile IUPAC Name: 3-(cyanomethylsulfanyl)-2-methylsulfonyl-3-sulfanylpropanenitrile Traditional Name: 3-(cyanomethylthio)-3-mercapto-2-mesyl-propionitrile Formula: C6H8N2O2S3 MolecularWeight: 236.33492

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(C#N)C(S)SCC#N

Isomeric SMILES

CS(=O)(=O)C(C#N)C(S)SCC#N

InChI

InChI=1S/C6H8N2O2S3/c1-13(9,10)5(4-8)6(11)12-3-2-7/h5-6,11H,3H2,1H3