5-chloranyl-2-methyl-1,2-thiazol-3-one; 2-methyl-1,2-thiazol-3-one

Systemtic Name: 5-chloranyl-2-methyl-1,2-thiazol-3-one; 2-methyl-1,2-thiazol-3-one Openeye Name: 5-chloro-2-methyl-isothiazol-3-one; 2-methylisothiazol-3-one CAS Name: 5-chloro-2-methyl-3-isothiazolone; 2-methyl-3-isothiazolone IUPAC Name: 5-chloro-2-methyl-1,2-thiazol-3-one; 2-methyl-1,2-thiazol-3-one Traditional Name: 5-chloro-2-methyl-4-isothiazolin-3-one; 2-methyl-4-isothiazolin-3-one Formula: C8H9ClN2O2S2 MolecularWeight: 264.75226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CS1.CN1C(=O)C=C(S1)Cl

Isomeric SMILES

CN1C(=O)C=CS1.CN1C(=O)C=C(S1)Cl

InChI

InChI=1S/C4H4ClNOS.C4H5NOS/c1-6-4(7)2-3(5)8-6;1-5-4(6)2-3-7-5/h2H,1H3;2-3H,1H3