5-(chloromethyl)-3-methyl-1,2-thiazol-4-one

Systemtic Name: 5-(chloromethyl)-3-methyl-1,2-thiazol-4-one Openeye Name: 5-(chloromethyl)-3-methyl-isothiazol-4-one CAS Name: 5-(chloromethyl)-3-methyl-4-isothiazolone IUPAC Name: 5-(chloromethyl)-3-methyl-1,2-thiazol-4-one Traditional Name: 5-(chloromethyl)-3-methyl-2-isothiazolin-4-one Formula: C5H6ClNOS MolecularWeight: 163.62524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(C1=O)CCl

Isomeric SMILES

CC1=NSC(C1=O)CCl

InChI

InChI=1S/C5H6ClNOS/c1-3-5(8)4(2-6)9-7-3/h4H,2H2,1H3