Vitas-M small molecule compound
4-methyl-2-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxyhexopyranosyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL480743
SMILES CC(=O)OCC1OC(C(C(C1OC(=O)C)OC(=O)C)NC(=O)C)n1ncn(c1=S)C
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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 C17H24N4O8S MW 444.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N4O8S/c1-8(22)19-13-15(28-11(4)25)14(27-10(3)24)12(6-26-9(2)23)29-16(13)21-17(30)20(5)7-18-21/h7,12-16H,6H2,1-5H3,(H,19,22)InChIKey
VBVSCGNNSVLHGZ-UHFFFAOYSA-NSynonyms
(5acetamido34diacetyloxy6(4methyl5sulfanylidene124triazol1yl)oxan2yl)methylacetate
4methyl2(346triOacetyl2(acetylamino)2deoxyhexopyranosyl)24dihydro3H124triazole3thione
CC(=O)NC1C(C(C(OC1N2C(=S)N(C=N2)C)COC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC17H24N4O8Sc18(22)191315(2811(4)25)14(2710(3)24)12(6269(2)23)2916(13)2117(30)20(5)71821h71216H6H215H3(H1922)
MFCD30713168
ZINC000102486746
ZINC000334161152
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