Vitas-M small molecule compound

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

Catalog ID
STK208740
SMILES OCC#CCSc1nnnn1c1ccc(cc1)OC

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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/c1-18-11-6-4-10(5-7-11)16-12(13-14-15-16)19-9-3-2-8-17/h4-7,17H,8-9H2,1H3
InChIKey
RBNGKASQYOPSIR-UHFFFAOYSA-N
Synonyms
727386-33-6
4((1(4METHOXYPHENYL)1HTETRAAZOL5YL)SULFANYL)2BUTYN1OL
4((1(4METHOXYPHENYL)1HTETRAZOL5YL)SULFANYL)BUT2YN1OL
4((1(4methoxyphenyl)1Htetrazol5yl)thio)but2yn1ol
4(1(4METHOXYPHENYL)1HTETRAZOL5YLSULFANYL)BUT2YN1OL
4(1(4METHOXYPHENYL)TETRAZOL5YL)SULFANYLBUT2YN1OL
727386336
COC1=CC=C(C=C1)N2C(=NN=N2)SCC#CCO
InChI=1SC12H12N4O2Sc118116410(5711)1612(13141516)19932817h4717H89H21H3
MFCD06193778
ZINC000002202543
ZINC02202543
ZINC2202543

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Available files

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