[3-methylsulfanyl-3-[6-(1-methylsulfanyldecyl)thian-2-yl]propyl] ethanoate

Systemtic Name: [3-methylsulfanyl-3-[6-(1-methylsulfanyldecyl)thian-2-yl]propyl] ethanoate Openeye Name: [3-methylsulfanyl-3-[6-(1-methylsulfanyldecyl)tetrahydrothiopyran-2-yl]propyl] acetate CAS Name: acetic acid [3-(methylthio)-3-[6-[1-(methylthio)decyl]-2-thianyl]propyl] ester IUPAC Name: [3-methylsulfanyl-3-[6-(1-methylsulfanyldecyl)thian-2-yl]propyl] acetate Traditional Name: acetic acid [3-(methylthio)-3-[6-[1-(methylthio)decyl]tetrahydrothiopyran-2-yl]propyl] ester Formula: C22H42O2S3 MolecularWeight: 434.76268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1CCCC(S1)C(CCOC(=O)C)SC)SC

Isomeric SMILES

CCCCCCCCCC(C1CCCC(S1)C(CCOC(=O)C)SC)SC

InChI

InChI=1S/C22H42O2S3/c1-5-6-7-8-9-10-11-13-19(25-3)21-14-12-15-22(27-21)20(26-4)16-17-24-18(2)23/h19-22H,5-17H2,1-4H3