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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 10:46, 20 February 2012 (Saving copy of the {{chembox}} taken from revid 442174255 of page Thioflavin for the Chem/Drugbox validation project (updated: 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 10:46, 20 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 442174255 of page Thioflavin for the Chem/Drugbox validation project (updated: 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 442174255 of page Thioflavin with values updated to verified values.
Thioflavin T
File:Thioflavin T.png
Names
IUPAC names 4-(3,6-dimethyl-1,3-benzothiazol-3
-ium-2-yl)-N,N-dimethylaniline chloride
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
PubChem CID
InChI
  • InChI=1S/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1Key: JADVWWSKYZXRGX-UHFFFAOYSA-M
  • InChI=1/C17H19N2S.ClH/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;/h5-11H,1-4H3;1H/q+1;/p-1Key: JADVWWSKYZXRGX-REWHXWOFAC
SMILES
  • .s2c1cc(ccc1(c2c3ccc(N(C)C)cc3)C)C
Properties
Chemical formula C17H19ClN2S
Molar mass 318.86 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Tracking categories (test):
Chemical compound
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