Vitas-M small molecule compound
2-{2-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-1H-pyrrol-1-yl}-N-(5-chloro-2-methoxyphenyl)acetamide
Catalog ID
STL075074
SMILES COc1ccc(cc1NC(=O)Cn1cccc1c1onc(n1)c1ccc2c(c1)OCO2)Cl
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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 C22H17ClN4O5 MW 452.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4O5/c1-29-17-7-5-14(23)10-15(17)24-20(28)11-27-8-2-3-16(27)22-25-21(26-32-22)13-4-6-18-19(9-13)31-12-30-18/h2-10H,11-12H2,1H3,(H,24,28)InChIKey
KFCWUZSIEVLSSM-UHFFFAOYSA-NSynonyms
2(2(3(13benzodioxol5yl)124oxadiazol5yl)1Hpyrrol1yl)N(5chloro2methoxyphenyl)acetamide
2(2(3(13benzodioxol5yl)124oxadiazol5yl)pyrrol1yl)N(5chloro2methoxyphenyl)acetamide
COC1=C(C=C(C=C1)Cl)NC(=O)CN2C=CC=C2C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC22H17ClN4O5c129177514(23)1015(17)2420(28)112782316(27)222521(263222)13461819(913)31123018h210H1112H21H3(H2428)
MFCD18196434
ZINC000057487062
ZINC57487062
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