Vitas-M small molecule compound
2-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-[3-(4H-1,2,4-triazol-3-yl)phenyl]acetamide
Catalog ID
STL411086
SMILES COc1ccc2c(c1OC)C(=O)OC2CC(=O)Nc1cccc(c1)c1[nH]cnn1
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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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-27-14-7-6-13-15(29-20(26)17(13)18(14)28-2)9-16(25)23-12-5-3-4-11(8-12)19-21-10-22-24-19/h3-8,10,15H,9H2,1-2H3,(H,23,25)(H,21,22,24)InChIKey
ZMGCIMFLYZTCHL-UHFFFAOYSA-NSynonyms
1630852-07-11630852071
2(45dimethoxy3oxo13dihydro2benzofuran1yl)N(3(4H124triazol3yl)phenyl)acetamide
2(45dimethoxy3oxo1H2benzofuran1yl)N(3(1H124triazol5yl)phenyl)acetamide
COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)NC3=CC=CC(=C3)C4=NC=NN4)OC
COc1ccc2c(c1OC)C(=O)OC2CC(=O)Nc1cccc(c1)c1(nH)cnn1
COc1ccc2c(c1OC)C(=O)OC2CC(=O)Nc1cccc(c1)c1nc(nH)n1
InChI=1SC20H18N4O5c12714761315(2920(26)17(13)18(14)282)916(25)231253411(812)192110222419h381015H9H212H3(H2325)(H212224)
MFCD30706530
N(3(1H124triazol3yl)phenyl)2(45dimethoxy3oxo13dihydroisobenzofuran1yl)acetamide
ZINC000218346163
ZINC000218346243
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