Vitas-M small molecule compound
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[3-oxo-8-(3-phenyl-1,2,4-oxadiazol-5-yl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetamide
Catalog ID
STL078969
SMILES O=C(Cn1nc2n(c1=O)cccc2c1onc(n1)c1ccccc1)Nc1cc2OCOc2cc1C(=O)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 C25H18N6O6 MW 498.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N6O6/c1-14(32)17-10-19-20(36-13-35-19)11-18(17)26-21(33)12-31-25(34)30-9-5-8-16(23(30)28-31)24-27-22(29-37-24)15-6-3-2-4-7-15/h2-11H,12-13H2,1H3,(H,26,33)InChIKey
ZDSVPYGEWQFKBC-UHFFFAOYSA-NSynonyms
CC(=O)C1=CC2=C(C=C1NC(=O)CN3C(=O)N4C=CC=C(C4=N3)C5=NC(=NO5)C6=CC=CC=C6)OCO2
InChI=1SC25H18N6O6c114(32)17101920(36133519)1118(17)2621(33)123125(34)3095816(23(30)2831)242722(293724)156324715h211H1213H21H3(H2633)
MFCD18200177
N(6acetyl13benzodioxol5yl)2(3oxo8(3phenyl124oxadiazol5yl)(124)triazolo(43a)pyridin2(3H)yl)acetamide
N(6acetyl13benzodioxol5yl)2(3oxo8(3phenyl124oxadiazol5yl)(124)triazolo(43a)pyridin2yl)acetamide
ZINC000067219204
ZINC67219204
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