93101-83-8 Purity
96%
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Specification
The molecular formula is C9H7FN2S.
It was created on 2005-08-08 and last modified on 2023-12-30.
The IUPAC Name is 4-(4-fluorophenyl)-1,3-dihydroimidazole-2-thione.
The InChI is InChI=1S/C9H7FN2S/c10-7-3-1-6(2-4-7)8-5-11-9(13)12-8/h1-5H,(H2,11,12,13).
The InChIKey is CQYXXBUINDPILP-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC(=CC=C1C2=CNC(=S)N2)F.
The molecular weight is 194.23 g/mol.
It has 2 hydrogen bond donor counts.
The topological polar surface area is 56.2 Ų.
Yes, the compound is canonicalized.