Vitas-M small molecule compound
5-phenyl-3-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxyhexopyranosyl]-1,3,4-oxadiazole-2(3H)-thione
Catalog ID
STL480728
SMILES CC(=O)OCC1OC(C(C(C1OC(=O)C)OC(=O)C)NC(=O)C)n1nc(oc1=S)c1ccccc1
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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 C22H25N3O9S MW 507.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O9S/c1-11(26)23-17-19(32-14(4)29)18(31-13(3)28)16(10-30-12(2)27)33-21(17)25-22(35)34-20(24-25)15-8-6-5-7-9-15/h5-9,16-19,21H,10H2,1-4H3,(H,23,26)InChIKey
LTFACHGUFVRXCD-UHFFFAOYSA-NSynonyms
(5acetamido34diacetyloxy6(5phenyl2sulfanylidene134oxadiazol3yl)oxan2yl)methylacetate
5phenyl3(346triOacetyl2(acetylamino)2deoxyhexopyranosyl)134oxadiazole2(3H)thione
CC(=O)NC1C(C(C(OC1N2C(=S)OC(=N2)C3=CC=CC=C3)COC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC22H25N3O9Sc111(26)231719(3214(4)29)18(3113(3)28)16(103012(2)27)3321(17)2522(35)3420(2425)158657915h59161921H10H214H3(H2326)
MFCD30713161
ZINC000102491124
ZINC000334160763
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