calcium 2-methyl-1,2-thiazol-3-one dichloride

Systemtic Name: calcium 2-methyl-1,2-thiazol-3-one dichloride Openeye Name: calcium 2-methylisothiazol-3-one dichloride CAS Name: calcium 2-methyl-3-isothiazolone dichloride IUPAC Name: calcium 2-methyl-1,2-thiazol-3-one dichloride Traditional Name: calcium 2-methyl-4-isothiazolin-3-one dichloride Formula: C4H5CaCl2NOS MolecularWeight: 226.1376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CS1.[Cl-].[Cl-].[Ca+2]

Isomeric SMILES

CN1C(=O)C=CS1.[Cl-].[Cl-].[Ca+2]

InChI

InChI=1S/C4H5NOS.Ca.2ClH/c1-5-4(6)2-3-7-5;;;/h2-3H,1H3;;2*1H/q;+2;;/p-2