CAS
946078-87-1 Purity
96%
946078-87-1 Purity
96%
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Specification
The molecular formula is C9H8N2O2S.
The molecular weight is 208.24 g/mol.
The IUPAC name is 6-methoxy-1,3-benzothiazole-2-carboxamide.
The InChI is InChI=1S/C9H8N2O2S/c1-13-5-2-3-6-7(4-5)14-9(11-6)8(10)12/h2-4H,1H3,(H2,10,12).
The InChIKey is KIJPPCHUGXJVFH-UHFFFAOYSA-N.
The canonical SMILES is COC1=CC2=C(C=C1)N=C(S2)C(=O)N.
The CAS number is 946-12-3.
The DSSTox Substance ID is DTXSID30337159.
The molecular weight is 208.24 g/mol.
Yes, it is a canonicalized compound according to PubChem.