Vitas-M small molecule compound
2-{2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL075265
SMILES O=C(Cn1cccc1c1onc(n1)c1cccc(c1)Cl)Nc1ccc2c(c1)OCCO2
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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 C22H17ClN4O4 MW 436.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O4/c23-15-4-1-3-14(11-15)21-25-22(31-26-21)17-5-2-8-27(17)13-20(28)24-16-6-7-18-19(12-16)30-10-9-29-18/h1-8,11-12H,9-10,13H2,(H,24,28)InChIKey
HMHCIDWNDJLILA-UHFFFAOYSA-NSynonyms
2(2(3(3chlorophenyl)124oxadiazol5yl)1Hpyrrol1yl)N(23dihydro14benzodioxin6yl)acetamide
2(2(3(3chlorophenyl)124oxadiazol5yl)pyrrol1yl)N(23dihydro14benzodioxin6yl)acetamide
C1COC2=C(O1)C=CC(=C2)NC(=O)CN3C=CC=C3C4=NC(=NO4)C5=CC(=CC=C5)Cl
InChI=1SC22H17ClN4O4c231541314(1115)212522(312621)1752827(17)1320(28)2416671819(1216)301092918h181112H91013H2(H2428)
MFCD18196625
ZINC000057487250
ZINC57487250
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