Vitas-M small molecule compound
ethyl {4-[3-amino-1-(7-chloro-1,3-benzodioxol-5-yl)-3-oxopropyl]-3-hydroxy-1H-pyrazol-5-yl}acetate
Catalog ID
STL425518
SMILES CCOC(=O)Cc1[nH]nc(c1C(c1cc(Cl)c2c(c1)OCO2)CC(=O)N)O
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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 C17H18ClN3O6 MW 395.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O6/c1-2-25-14(23)6-11-15(17(24)21-20-11)9(5-13(19)22)8-3-10(18)16-12(4-8)26-7-27-16/h3-4,9H,2,5-7H2,1H3,(H2,19,22)(H2,20,21,24)InChIKey
YMVBOVNZJNYSOC-UHFFFAOYSA-NSynonyms
1630831-04-71630831047
CCOC(=O)Cc1(nH)nc(c1C(c1cc(Cl)c2c(c1)OCO2)CC(=O)N)O
CCOC(=O)CC1=C(C(=O)NN1)C(CC(=O)N)C2=CC3=C(C(=C2)Cl)OCO3
ethyl(4(3amino1(7chloro13benzodioxol5yl)3oxopropyl)3hydroxy1Hpyrazol5yl)acetate
ethyl2(4(3amino1(7chloro13benzodioxol5yl)3oxopropyl)5oxo12dihydropyrazol3yl)acetate
InChI=1SC17H18ClN3O6c122514(23)61115(17(24)212011)9(513(19)22)8310(18)1612(48)2672716h349H257H21H3(H21922)(H2202124)
MFCD30710035
ZINC000218155618
ZINC000218155685
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