S-[(2,4,6-trimethoxyphenyl)methyl] ethanethioate

Systemtic Name: S-[(2,4,6-trimethoxyphenyl)methyl] ethanethioate Openeye Name: S-[(2,4,6-trimethoxyphenyl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(2,4,6-trimethoxyphenyl)methyl] ester IUPAC Name: S-[(2,4,6-trimethoxyphenyl)methyl] ethanethioate Traditional Name: ethanethioic acid S-(2,4,6-trimethoxybenzyl) ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=C(C=C(C=C1OC)OC)OC

Isomeric SMILES

CC(=O)SCC1=C(C=C(C=C1OC)OC)OC

InChI

InChI=1S/C12H16O4S/c1-8(13)17-7-10-11(15-3)5-9(14-2)6-12(10)16-4/h5-6H,7H2,1-4H3