S-[2-oxidanyl-3-[(prop-2-enoylamino)methoxy]propyl] ethanethioate

Systemtic Name: S-[2-oxidanyl-3-[(prop-2-enoylamino)methoxy]propyl] ethanethioate Openeye Name: S-[2-hydroxy-3-[(prop-2-enoylamino)methoxy]propyl] ethanethioate CAS Name: ethanethioic acid S-[2-hydroxy-3-[(1-oxoprop-2-enylamino)methoxy]propyl] ester IUPAC Name: S-[2-hydroxy-3-[(prop-2-enoylamino)methoxy]propyl] ethanethioate Traditional Name: ethanethioic acid S-[3-(acrylamidomethoxy)-2-hydroxy-propyl] ester Formula: C9H15NO4S MolecularWeight: 233.2847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(COCNC(=O)C=C)O

Isomeric SMILES

CC(=O)SCC(COCNC(=O)C=C)O

InChI

InChI=1S/C9H15NO4S/c1-3-9(13)10-6-14-4-8(12)5-15-7(2)11/h3,8,12H,1,4-6H2,2H3,(H,10,13)