5-chloranyl-2-(2-oxidanylidenebut-3-enyl)-1,2-thiazol-3-one

Systemtic Name: 5-chloranyl-2-(2-oxidanylidenebut-3-enyl)-1,2-thiazol-3-one Openeye Name: 5-chloro-2-(2-oxobut-3-enyl)isothiazol-3-one CAS Name: 5-chloro-2-(2-oxobut-3-enyl)-3-isothiazolone IUPAC Name: 5-chloro-2-(2-oxobut-3-enyl)-1,2-thiazol-3-one Traditional Name: 5-chloro-2-(2-ketobut-3-enyl)-4-isothiazolin-3-one Formula: C7H6ClNO2S MolecularWeight: 203.64604

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)CN1C(=O)C=C(S1)Cl

Isomeric SMILES

C=CC(=O)CN1C(=O)C=C(S1)Cl

InChI

InChI=1S/C7H6ClNO2S/c1-2-5(10)4-9-7(11)3-6(8)12-9/h2-3H,1,4H2