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

Systemtic Name: 4,5-bis(chloranyl)-2-heptyl-1,2-thiazol-3-one Openeye Name: 4,5-dichloro-2-heptyl-isothiazol-3-one CAS Name: 4,5-dichloro-2-heptyl-3-isothiazolone IUPAC Name: 4,5-dichloro-2-heptyl-1,2-thiazol-3-one Traditional Name: 4,5-dichloro-2-heptyl-4-isothiazolin-3-one Formula: C10H15Cl2NOS MolecularWeight: 268.2032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)C(=C(S1)Cl)Cl

Isomeric SMILES

CCCCCCCN1C(=O)C(=C(S1)Cl)Cl

InChI

InChI=1S/C10H15Cl2NOS/c1-2-3-4-5-6-7-13-10(14)8(11)9(12)15-13/h2-7H2,1H3