S-[(6-bromanylpyridin-3-yl)methyl] ethanethioate

Systemtic Name: S-[(6-bromanylpyridin-3-yl)methyl] ethanethioate Openeye Name: S-[(6-bromo-3-pyridyl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(6-bromo-3-pyridinyl)methyl] ester IUPAC Name: S-[(6-bromopyridin-3-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(6-bromo-3-pyridyl)methyl] ester Formula: C8H8BrNOS MolecularWeight: 246.12422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CN=C(C=C1)Br

Isomeric SMILES

CC(=O)SCC1=CN=C(C=C1)Br

InChI

InChI=1S/C8H8BrNOS/c1-6(11)12-5-7-2-3-8(9)10-4-7/h2-4H,5H2,1H3