Vitas-M small molecule compound
N-[4-(5-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1,2,5-oxadiazol-3-yl]acetamide
Catalog ID
STK744239
SMILES CCn1c(nnc1c1nonc1NC(=O)C)SCc1cc2OCOc2cc1Br
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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 C16H15BrN6O4S MW 467.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN6O4S/c1-3-23-15(13-14(18-8(2)24)22-27-21-13)19-20-16(23)28-6-9-4-11-12(5-10(9)17)26-7-25-11/h4-5H,3,6-7H2,1-2H3,(H,18,22,24)InChIKey
ITSLITRSZYJIMO-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC2=CC3=C(C=C2Br)OCO3)C4=NON=C4NC(=O)C
InChI=1SC16H15BrN6O4Sc132315(1314(188(2)24)22272113)192016(23)286941112(510(9)17)2672511h45H367H212H3(H182224)
MFCD09221508
N(4(5(((6bromo13benzodioxol5yl)methyl)sulfanyl)4ethyl4H124triazol3yl)125oxadiazol3yl)acetamide
N(4(5((6bromo13benzodioxol5yl)methylsulfanyl)4ethyl124triazol3yl)125oxadiazol3yl)acetamide
ZINC000009877685
ZINC09877685
ZINC9877685
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