Vitas-M small molecule compound
(1S,2S,5R)-2-(5-methyl-2-thioxo-1,3,4-thiadiazol-3(2H)-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one (non-preferred name)
Catalog ID
STK775873
SMILES Cc1nn(c(=S)s1)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2
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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 C9H10N2O3S2 MW 258.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10N2O3S2/c1-4-10-11(9(15)16-4)5-2-6(12)8-13-3-7(5)14-8/h5,7-8H,2-3H2,1H3/t5-,7?,8+/m0/s1InChIKey
QMKPZJRWARXWIR-IRAGSFCVSA-NSynonyms
(1S2S5R)2(5methyl2sulfanylidene134thiadiazol3yl)68dioxabicyclo(321)octan4one
(1S2S5R)2(5methyl2thioxo134thiadiazol3(2H)yl)68dioxabicyclo(321)octan4one(nonpreferredname)
CC1=NN(C(=S)S1)C2CC(=O)C3OCC2O3
Cc1nn(c(=S)s1)(C@H)1CC(=O)(C@H)2O(C@@H)1CO2
InChI=1SC9H10N2O3S2c141011(9(15)164)526(12)81337(5)148h578H23H21H3t57+8+m0s1
MFCD13372204
ZINC000006667745
ZINC06667745
ZINC6667745
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