[1-phenyl-2-(pyridin-4-ylmethylsulfanyl)ethyl] ethanoate

Systemtic Name: [1-phenyl-2-(pyridin-4-ylmethylsulfanyl)ethyl] ethanoate Openeye Name: [1-phenyl-2-(4-pyridylmethylsulfanyl)ethyl] acetate CAS Name: acetic acid [1-phenyl-2-(pyridin-4-ylmethylthio)ethyl] ester IUPAC Name: [1-phenyl-2-(pyridin-4-ylmethylsulfanyl)ethyl] acetate Traditional Name: acetic acid [1-phenyl-2-(4-pyridylmethylthio)ethyl] ester Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CSCC1=CC=NC=C1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OC(CSCC1=CC=NC=C1)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO2S/c1-13(18)19-16(15-5-3-2-4-6-15)12-20-11-14-7-9-17-10-8-14/h2-10,16H,11-12H2,1H3