1964-45-0 Purity
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Specification
The molecular formula of the compound is C6H6N2S.
The molecular weight of the compound is 138.19 g/mol.
The IUPAC name of the compound is 2-amino-5-methylthiophene-3-carbonitrile.
The InChI of the compound is InChI=1S/C6H6N2S/c1-4-2-5(3-7)6(8)9-4/h2H,8H2,1H3.
The InChIKey of the compound is YGXADLPRHBRTPG-UHFFFAOYSA-N.
The canonical SMILES of the compound is CC1=CC(=C(S1)N)C#N.
The CAS number of the compound is 138564-58-6.
The European Community (EC) number of the compound is 604-082-4.
The UNII of the compound is VK4FNV7HCG.
Yes, the compound is canonicalized.