S-(2-pyridin-3-ylethyl) ethanethioate

Systemtic Name: S-(2-pyridin-3-ylethyl) ethanethioate Openeye Name: S-[2-(3-pyridyl)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(3-pyridinyl)ethyl] ester IUPAC Name: S-(2-pyridin-3-ylethyl) ethanethioate Traditional Name: ethanethioic acid S-[2-(3-pyridyl)ethyl] ester Formula: C9H11NOS MolecularWeight: 181.25474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC1=CN=CC=C1

Isomeric SMILES

CC(=O)SCCC1=CN=CC=C1

InChI

InChI=1S/C9H11NOS/c1-8(11)12-6-4-9-3-2-5-10-7-9/h2-3,5,7H,4,6H2,1H3