Vitas-M small molecule compound

4-[5-(methylsulfanyl)-1H-tetrazol-1-yl]benzoic acid

Catalog ID
STK361340
SMILES CSc1nnnn1c1ccc(cc1)C(=O)O

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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 C9H8N4O2S MW 236.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8N4O2S/c1-16-9-10-11-12-13(9)7-4-2-6(3-5-7)8(14)15/h2-5H,1H3,(H,14,15)
InChIKey
RGLFMDVMQULYPX-UHFFFAOYSA-N
Synonyms
634176-17-3
4(5(METHYLSULFANYL)1HTETRAAZOL1YL)BENZOICACID
4(5(methylsulfanyl)1Htetrazol1yl)benzoicacid
4(5(methylthio)1Htetrazol1yl)benzoicacid
4(5METHYLSULFANYLTETRAZOL1YL)BENZOICACID
634176173
CSC1=NN=NN1C2=CC=C(C=C2)C(=O)O
InChI=1SC9H8N4O2Sc116910111213(9)7426(357)8(14)15h25H1H3(H1415)
MFCD03820319
ZINC000000536847
ZINC536847

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Available files

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