Vitas-M small molecule compound

5-(2H-tetrazol-5-yl)-1,3-benzoxazole-2-thiol

Catalog ID
STK826159
SMILES Sc1oc2c(n1)cc(cc2)c1n[nH]nn1

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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 C8H5N5OS MW 219.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H5N5OS/c15-8-9-5-3-4(1-2-6(5)14-8)7-10-12-13-11-7/h1-3H,(H,9,15)(H,10,11,12,13)
InChIKey
QKFBUCWOXFBFIB-UHFFFAOYSA-N
Synonyms
1207606-03-8
1207606038
5(2Htetrazol5yl)13benzoxazole2thiol
5(2Htetrazol5yl)3H13benzoxazole2thione
C1=CC2=C(C=C1C3=NNN=N3)NC(=S)O2
InChI=1SC8H5N5OSc1589534(126(5)148)7101213117h13H(H915)(H10111213)
MFCD18169628
Sc1oc2c(n1)cc(cc2)c1n(nH)nn1
ZINC000039389360
ZINC39389360

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Available files

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