Vitas-M small molecule compound

2-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-N-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]acetamide

Catalog ID
STL423132
SMILES COc1c(OC)ccc2c1C(=O)OC2CC(=O)Nc1ccc(cc1)Cn1cncn1

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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 C21H20N4O5 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5/c1-28-16-8-7-15-17(30-21(27)19(15)20(16)29-2)9-18(26)24-14-5-3-13(4-6-14)10-25-12-22-11-23-25/h3-8,11-12,17H,9-10H2,1-2H3,(H,24,26)
InChIKey
OFKUWECXKLTWOW-UHFFFAOYSA-N
Synonyms
1630851-72-7
1630851727
2(45dimethoxy3oxo13dihydro2benzofuran1yl)N(4(1H124triazol1ylmethyl)phenyl)acetamide
2(45dimethoxy3oxo1H2benzofuran1yl)N(4(124triazol1ylmethyl)phenyl)acetamide
COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)NC3=CC=C(C=C3)CN4C=NC=N4)OC
InChI=1SC21H20N4O5c12816871517(3021(27)19(15)20(16)292)918(26)24145313(4614)10251222112325h38111217H910H212H3(H2426)
MFCD28367934
N(4((1H124triazol1yl)methyl)phenyl)2(45dimethoxy3oxo13dihydroisobenzofuran1yl)acetamide
ZINC000218334137
ZINC000218334222

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Available files

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