methyl 2-cyano-2,2-bis(phenylmethylsulfanyl)ethanoate

Systemtic Name: methyl 2-cyano-2,2-bis(phenylmethylsulfanyl)ethanoate Openeye Name: methyl 2,2-bis(benzylsulfanyl)-2-cyano-acetate CAS Name: 2-cyano-2,2-bis(phenylmethylthio)acetic acid methyl ester IUPAC Name: methyl 2,2-bis(benzylsulfanyl)-2-cyanoacetate Traditional Name: 2,2-bis(benzylthio)-2-cyano-acetic acid methyl ester Formula: C18H17NO2S2 MolecularWeight: 343.46308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)(SCC1=CC=CC=C1)SCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C#N)(SCC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C18H17NO2S2/c1-21-17(20)18(14-19,22-12-15-8-4-2-5-9-15)23-13-16-10-6-3-7-11-16/h2-11H,12-13H2,1H3