Vitas-M small molecule compound

4-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}but-2-yn-1-ol

Catalog ID
STK245223
SMILES OCC#CCSc1nnnn1c1ccccc1OC

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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 C12H12N4O2S MW 276.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O2S/c1-18-11-7-3-2-6-10(11)16-12(13-14-15-16)19-9-5-4-8-17/h2-3,6-7,17H,8-9H2,1H3
InChIKey
RTFVFSIZRFEGPN-UHFFFAOYSA-N
Synonyms
892699-56-8
4((1(2methoxyphenyl)1Htetrazol5yl)sulfanyl)but2yn1ol
4(1(2methoxyphenyl)tetrazol5yl)sulfanylbut2yn1ol
892699568
COC1=CC=CC=C1N2C(=NN=N2)SCC#CCO
InChI=1SC12H12N4O2Sc11811732610(11)1612(13141516)19954817h236717H89H21H3
MFCD08681207
ZINC000013843987
ZINC13843987

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Available files

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