4-prop-2-ynyl-1,2-thiazol-3-one

Systemtic Name: 4-prop-2-ynyl-1,2-thiazol-3-one Openeye Name: 4-prop-2-ynylisothiazol-3-one CAS Name: 4-prop-2-ynyl-3-isothiazolone IUPAC Name: 4-prop-2-ynyl-1,2-thiazol-3-one Traditional Name: 4-propargyl-4-isothiazolin-3-one Formula: C6H5NOS MolecularWeight: 139.175

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1=CSNC1=O

Isomeric SMILES

C#CCC1=CSNC1=O

InChI

InChI=1S/C6H5NOS/c1-2-3-5-4-9-7-6(5)8/h1,4H,3H2,(H,7,8)