2-butyl-5-chloranyl-1,2-thiazol-3-one

Systemtic Name: 2-butyl-5-chloranyl-1,2-thiazol-3-one Openeye Name: 2-butyl-5-chloro-isothiazol-3-one CAS Name: 2-butyl-5-chloro-3-isothiazolone IUPAC Name: 2-butyl-5-chloro-1,2-thiazol-3-one Traditional Name: 2-butyl-5-chloro-4-isothiazolin-3-one Formula: C7H10ClNOS MolecularWeight: 191.6784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C=C(S1)Cl

Isomeric SMILES

CCCCN1C(=O)C=C(S1)Cl

InChI

InChI=1S/C7H10ClNOS/c1-2-3-4-9-7(10)5-6(8)11-9/h5H,2-4H2,1H3