[2-[1-(phenylmethylsulfanyl)ethyl]-1,3-dithiolan-4-yl]methyl 2-methylprop-2-enoate

Systemtic Name: [2-[1-(phenylmethylsulfanyl)ethyl]-1,3-dithiolan-4-yl]methyl 2-methylprop-2-enoate Openeye Name: [2-(1-benzylsulfanylethyl)-1,3-dithiolan-4-yl]methyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [2-[1-(phenylmethylthio)ethyl]-1,3-dithiolan-4-yl]methyl ester IUPAC Name: [2-(1-benzylsulfanylethyl)-1,3-dithiolan-4-yl]methyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [2-[1-(benzylthio)ethyl]-1,3-dithiolan-4-yl]methyl ester Formula: C17H22O2S3 MolecularWeight: 354.55038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1SCC(S1)COC(=O)C(=C)C)SCC2=CC=CC=C2

Isomeric SMILES

CC(C1SCC(S1)COC(=O)C(=C)C)SCC2=CC=CC=C2

InChI

InChI=1S/C17H22O2S3/c1-12(2)16(18)19-9-15-11-21-17(22-15)13(3)20-10-14-7-5-4-6-8-14/h4-8,13,15,17H,1,9-11H2,2-3H3