Vitas-M small molecule compound

5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK846827
SMILES COc1ccc(cc1)n1c(S)nnc1c1ccco1

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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 C13H11N3O2S MW 273.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O2S/c1-17-10-6-4-9(5-7-10)16-12(14-15-13(16)19)11-3-2-8-18-11/h2-8H,1H3,(H,15,19)
InChIKey
IUUXUQJNQPJBCJ-UHFFFAOYSA-N
Synonyms
60870-42-0
5(furan2yl)4(4methoxyphenyl)4H124triazole3thiol
60870420
COC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CO3
InChI=1SC13H11N3O2Sc11710649(5710)1612(141513(16)19)113281811h28H1H3(H1519)
MFCD01408813

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Available files

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