Vitas-M small molecule compound

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

Catalog ID
STK335788
SMILES OC(=O)Cn1c(S)nnc1c1n[nH]cc1

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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 C7H7N5O2S MW 225.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H7N5O2S/c13-5(14)3-12-6(10-11-7(12)15)4-1-2-8-9-4/h1-2H,3H2,(H,8,9)(H,11,15)(H,13,14)
InChIKey
PFBBJGUUVANPLT-UHFFFAOYSA-N
Synonyms
879447-36-6
(3(1Hpyrazol3yl)5sulfanyl4H124triazol4yl)aceticacid
2(3(1HPYRAZOL5YL)5SULFANYLIDENE1H124TRIAZOL4YL)ACETICACID
2(3mercapto5(1Hpyrazol5yl)4H124triazol4yl)aceticacid
879447366
C1=C(NN=C1)C2=NNC(=S)N2CC(=O)O
InChI=1SC7H7N5O2Sc135(14)3126(10117(12)15)412894h12H3H2(H89)(H1115)(H1314)
MFCD09964266
OC(=O)Cn1c(S)nnc1c1ccn(nH)1
OC(=O)Cn1c(S)nnc1c1n(nH)cc1
ZINC5790709

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Available files

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