Vitas-M small molecule compound

5-phenyl-1,3-benzothiazole-2-thiol

Catalog ID
STK366304
SMILES Sc1sc2c(n1)cc(cc2)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H9NS2 MW 243.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9NS2/c15-13-14-11-8-10(6-7-12(11)16-13)9-4-2-1-3-5-9/h1-8H,(H,14,15)
InChIKey
PNVQWHLXRYACFG-UHFFFAOYSA-N
Synonyms
117138-27-9
117138279
5PHENYL13BENZOTHIAZOLE2(3H)THIONE
5phenyl13benzothiazole2thiol
5PHENYL2MERCAPTOBENZOTHIAZOLE
5PHENYL3H13BENZOTHIAZOLE2THIONE
5PHENYLBENZOTHIAZOLE2THIOL
C1=CC=C(C=C1)C2=CC3=C(C=C2)SC(=S)N3
InChI=1SC13H9NS2c15131411810(6712(11)1613)9421359h18H(H1415)
MFCD00458838
ZINC000000177108
ZINC00177108
ZINC177108

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.