Vitas-M small molecule compound

3-(5-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-1H-tetrazol-1-yl)pyridine

Catalog ID
STK784561
SMILES Brc1cc2OCOc2cc1CSc1nnnn1c1cccnc1

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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 C14H10BrN5O2S MW 392.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10BrN5O2S/c15-11-5-13-12(21-8-22-13)4-9(11)7-23-14-17-18-19-20(14)10-2-1-3-16-6-10/h1-6H,7-8H2
InChIKey
DRKJFLVLGKBGCG-UHFFFAOYSA-N
Synonyms

3(5(((6bromo13benzodioxol5yl)methyl)sulfanyl)1Htetrazol1yl)pyridine
3(5((6BROMO13BENZODIOXOL5YL)METHYLSULFANYL)TETRAZOL1YL)PYRIDINE
C1OC2=C(O1)C=C(C(=C2)CSC3=NN=NN3C4=CN=CC=C4)Br
InChI=1SC14H10BrN5O2Sc151151312(2182213)49(11)7231417181920(14)1021316610h16H78H2
MFCD07022568
ZINC000004709098
ZINC04709098
ZINC4709098

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Available files

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