3,3-bis(methylsulfanyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: 3,3-bis(methylsulfanyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: 2-benzoyl-3,3-bis(methylsulfanyl)prop-2-enenitrile CAS Name: 2-benzoyl-3,3-bis(methylthio)-2-propenenitrile IUPAC Name: 2-benzoyl-3,3-bis(methylsulfanyl)prop-2-enenitrile Traditional Name: 2-benzoyl-3,3-bis(methylthio)acrylonitrile Formula: C12H11NOS2 MolecularWeight: 249.35184

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)C(=O)C1=CC=CC=C1)SC

Isomeric SMILES

CSC(=C(C#N)C(=O)C1=CC=CC=C1)SC

InChI

InChI=1S/C12H11NOS2/c1-15-12(16-2)10(8-13)11(14)9-6-4-3-5-7-9/h3-7H,1-2H3