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

Systemtic Name: [1-(4-methoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)ethyl] ethanoate Openeye Name: [1-(4-methoxyphenyl)-2-(4-pyridylmethylsulfanyl)ethyl] acetate CAS Name: acetic acid [1-(4-methoxyphenyl)-2-(pyridin-4-ylmethylthio)ethyl] ester IUPAC Name: [1-(4-methoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)ethyl] acetate Traditional Name: acetic acid [1-(4-methoxyphenyl)-2-(4-pyridylmethylthio)ethyl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO3S/c1-13(19)21-17(15-3-5-16(20-2)6-4-15)12-22-11-14-7-9-18-10-8-14/h3-10,17H,11-12H2,1-2H3