Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STK683048
SMILES OC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N
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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 C12H8N6O5 MW 316.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8N6O5/c13-10-11(16-23-15-10)18-9(8(12(19)20)14-17-18)5-1-2-6-7(3-5)22-4-21-6/h1-3H,4H2,(H2,13,15)(H,19,20)InChIKey
NMONDPGLANTDGN-UHFFFAOYSA-NSynonyms
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)1H123triazole4carboxylicacid
1(4AMINO125OXADIAZOL3YL)5(13BENZODIOXOL5YL)TRIAZOLE4CARBOXYLICACID
C1OC2=C(O1)C=C(C=C2)C3=C(N=NN3C4=NON=C4N)C(=O)O
InChI=1SC12H8N6O5c131011(16231510)189(8(12(19)20)141718)51267(35)224216h13H4H2(H21315)(H1920)
MFCD04061902
ZINC000002848453
ZINC2848453
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