4,5-bis(chloranyl)-2-hexyl-1,2-thiazol-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-hexyl-1,2-thiazol-3-one Openeye Name: 4,5-dichloro-2-hexyl-isothiazol-3-one CAS Name: 4,5-dichloro-2-hexyl-3-isothiazolone IUPAC Name: 4,5-dichloro-2-hexyl-1,2-thiazol-3-one Traditional Name: 4,5-dichloro-2-hexyl-4-isothiazolin-3-one Formula: C9H13Cl2NOS MolecularWeight: 254.17662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(=C(S1)Cl)Cl

Isomeric SMILES

CCCCCCN1C(=O)C(=C(S1)Cl)Cl

InChI

InChI=1S/C9H13Cl2NOS/c1-2-3-4-5-6-12-9(13)7(10)8(11)14-12/h2-6H2,1H3