[2-(pentylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate

Systemtic Name: [2-(pentylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate Openeye Name: [2-(pentylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate CAS Name: 2-propenoic acid [2-[(pentylthio)methyl]-1,3-dithiolan-4-yl]methyl ester IUPAC Name: [2-(pentylsulfanylmethyl)-1,3-dithiolan-4-yl]methyl prop-2-enoate Traditional Name: acrylic acid [2-[(amylthio)methyl]-1,3-dithiolan-4-yl]methyl ester Formula: C13H22O2S3 MolecularWeight: 306.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSCC1SCC(S1)COC(=O)C=C

Isomeric SMILES

CCCCCSCC1SCC(S1)COC(=O)C=C

InChI

InChI=1S/C13H22O2S3/c1-3-5-6-7-16-10-13-17-9-11(18-13)8-15-12(14)4-2/h4,11,13H,2-3,5-10H2,1H3