S-[[5-(methylsulfanylmethyl)-1,4-dithian-2-yl]methyl] 4-ethanoylcyclohexane-1-carbothioate

Systemtic Name: S-[[5-(methylsulfanylmethyl)-1,4-dithian-2-yl]methyl] 4-ethanoylcyclohexane-1-carbothioate Openeye Name: S-[[5-(methylsulfanylmethyl)-1,4-dithian-2-yl]methyl] 4-acetylcyclohexanecarbothioate CAS Name: 4-acetyl-1-cyclohexanecarbothioic acid S-[[5-[(methylthio)methyl]-1,4-dithian-2-yl]methyl] ester IUPAC Name: S-[[5-(methylsulfanylmethyl)-1,4-dithian-2-yl]methyl] 4-acetylcyclohexane-1-carbothioate Traditional Name: 4-acetylcyclohexanecarbothioic acid S-[[5-[(methylthio)methyl]-1,4-dithian-2-yl]methyl] ester Formula: C16H26O2S4 MolecularWeight: 378.63644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC(CC1)C(=O)SCC2CSC(CS2)CSC

Isomeric SMILES

CC(=O)C1CCC(CC1)C(=O)SCC2CSC(CS2)CSC

InChI

InChI=1S/C16H26O2S4/c1-11(17)12-3-5-13(6-4-12)16(18)22-10-15-9-20-14(7-19-2)8-21-15/h12-15H,3-10H2,1-2H3