S-[(2-methylpyridin-4-yl)methyl] ethanethioate

Systemtic Name: S-[(2-methylpyridin-4-yl)methyl] ethanethioate Openeye Name: S-[(2-methyl-4-pyridyl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(2-methyl-4-pyridinyl)methyl] ester IUPAC Name: S-[(2-methylpyridin-4-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(2-methyl-4-pyridyl)methyl] ester Formula: C9H11NOS MolecularWeight: 181.25474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)CSC(=O)C

Isomeric SMILES

CC1=NC=CC(=C1)CSC(=O)C

InChI

InChI=1S/C9H11NOS/c1-7-5-9(3-4-10-7)6-12-8(2)11/h3-5H,6H2,1-2H3