butyl 3-(3-oxidanylidene-1,2-thiazol-2-yl)propanoate

Systemtic Name: butyl 3-(3-oxidanylidene-1,2-thiazol-2-yl)propanoate Openeye Name: butyl 3-(3-oxoisothiazol-2-yl)propanoate CAS Name: 3-(3-oxo-2-isothiazolyl)propanoic acid butyl ester IUPAC Name: butyl 3-(3-oxo-1,2-thiazol-2-yl)propanoate Traditional Name: 3-(3-keto-4-isothiazolin-2-yl)propionic acid butyl ester Formula: C10H15NO3S MolecularWeight: 229.296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCN1C(=O)C=CS1

Isomeric SMILES

CCCCOC(=O)CCN1C(=O)C=CS1

InChI

InChI=1S/C10H15NO3S/c1-2-3-7-14-10(13)4-6-11-9(12)5-8-15-11/h5,8H,2-4,6-7H2,1H3