Vitas-M small molecule compound

2-[3-(pyrazin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]propanoic acid

Catalog ID
STK687400
SMILES OC(=O)C(n1c(S)nnc1c1cnccn1)C

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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 C9H9N5O2S MW 251.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9N5O2S/c1-5(8(15)16)14-7(12-13-9(14)17)6-4-10-2-3-11-6/h2-5H,1H3,(H,13,17)(H,15,16)
InChIKey
QEQQVRTUUIMZOA-UHFFFAOYSA-N
Synonyms

2(3(pyrazin2yl)5sulfanyl4H124triazol4yl)propanoicacid
2(3PYRAZIN2YL5SULFANYLIDENE1H124TRIAZOL4YL)PROPANOICACID
4H124TRIAZOLE4ACETICACID3MERCAPTOALPHAMETHYL5(2PYRAZINYL)
CC(C(=O)O)N1C(=NNC1=S)C2=NC=CN=C2
InChI=1SC9H9N5O2Sc15(8(15)16)147(12139(14)17)641023116h25H1H3(H1317)(H1516)
MFCD06618611
ZINC000004751627
ZINC000004751629

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Available files

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