Vitas-M small molecule compound
methyl 3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-[2-(pyridin-2-ylmethoxy)phenyl]propanoate
Catalog ID
STL314145
SMILES COC(=O)CC(c1c(C)[nH]nc1O)c1ccccc1OCc1ccccn1
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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 C20H21N3O4 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4/c1-13-19(20(25)23-22-13)16(11-18(24)26-2)15-8-3-4-9-17(15)27-12-14-7-5-6-10-21-14/h3-10,16H,11-12H2,1-2H3,(H2,22,23,25)InChIKey
RPJKPNDJGPMOKD-UHFFFAOYSA-NSynonyms
1435983-99-51435983995
CC1=C(C(=O)NN1)C(CC(=O)OC)C2=CC=CC=C2OCC3=CC=CC=N3
COC(=O)CC(c1c(C)(nH)nc1O)c1ccccc1OCc1ccccn1
InChI=1SC20H21N3O4c11319(20(25)232213)16(1118(24)262)15834917(15)271214756102114h31016H1112H212H3(H2222325)
methyl3(3hydroxy5methyl1Hpyrazol4yl)3(2(pyridin2ylmethoxy)phenyl)propanoate
methyl3(3methyl5oxo12dihydropyrazol4yl)3(2(pyridin2ylmethoxy)phenyl)propanoate
MFCD28030530
ZINC000095476115
ZINC000095476116
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