Vitas-M small molecule compound
1-C-(6-thioxo-1,2,4,5-tetrazinan-3-yl)pentitol
Catalog ID
STK369967
SMILES OCC(C(C(C(C1NNC(=S)NN1)O)O)O)O
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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 C7H16N4O5S MW 268.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H16N4O5S/c12-1-2(13)3(14)4(15)5(16)6-8-10-7(17)11-9-6/h2-6,8-9,12-16H,1H2,(H2,10,11,17)InChIKey
OOOJWEASRKBWBV-UHFFFAOYSA-NSynonyms
1C(6thioxo1245tetrazinan3yl)pentitol
6(12345pentahydroxypentyl)1245tetrazinane3thione
C(C(C(C(C(C1NNC(=S)NN1)O)O)O)O)O
InChI=1SC7H16N4O5Sc1212(13)3(14)4(15)5(16)68107(17)1196h26891216H1H2(H2101117)
MFCD00413582
ZINC000004018032
ZINC000239173749
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