(1-phenyl-2-propan-2-ylsulfanyl-ethyl) ethanoate

Systemtic Name: (1-phenyl-2-propan-2-ylsulfanyl-ethyl) ethanoate Openeye Name: (2-isopropylsulfanyl-1-phenyl-ethyl) acetate CAS Name: acetic acid [1-phenyl-2-(propan-2-ylthio)ethyl] ester IUPAC Name: (1-phenyl-2-propan-2-ylsulfanylethyl) acetate Traditional Name: acetic acid [2-(isopropylthio)-1-phenyl-ethyl] ester Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC(C1=CC=CC=C1)OC(=O)C

Isomeric SMILES

CC(C)SCC(C1=CC=CC=C1)OC(=O)C

InChI

InChI=1S/C13H18O2S/c1-10(2)16-9-13(15-11(3)14)12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3