CAS
914916-98-6 Purity
96%
914916-98-6 Purity
96%
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The molecular formula is C12H11NS.
It was created on 2007-02-05 and last modified on 2023-12-30.
The IUPAC name is 5-methyl-1-phenylpyridine-2-thione.
The InChI is InChI=1S/C12H11NS/c1-10-7-8-12(14)13(9-10)11-5-3-2-4-6-11/h2-9H,1H3.
The Canonical SMILES is CC1=CN(C(=S)C=C1)C2=CC=CC=C2.
The molecular weight is 201.29 g/mol.
The XLogP3-AA value is 2.5.
It has 0 hydrogen bond donor count.
The exact mass is 201.06122053 g/mol.
Yes, the compound is canonicalized.