3-ethyl-4-(1,3-oxazol-5-ylmethyl)thiolan-2-one

Systemtic Name: 3-ethyl-4-(1,3-oxazol-5-ylmethyl)thiolan-2-one Openeye Name: 3-ethyl-4-(oxazol-5-ylmethyl)tetrahydrothiophen-2-one CAS Name: 3-ethyl-4-(5-oxazolylmethyl)-2-thiolanone IUPAC Name: 3-ethyl-4-(1,3-oxazol-5-ylmethyl)thiolan-2-one Traditional Name: 3-ethyl-4-(oxazol-5-ylmethyl)tetrahydrothiophen-2-one Formula: C10H13NO2S MolecularWeight: 211.28072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CSC1=O)CC2=CN=CO2

Isomeric SMILES

CCC1C(CSC1=O)CC2=CN=CO2

InChI

InChI=1S/C10H13NO2S/c1-2-9-7(5-14-10(9)12)3-8-4-11-6-13-8/h4,6-7,9H,2-3,5H2,1H3