Vitas-M small molecule compound

methyl 3-(5-benzyl-3-hydroxy-1H-pyrazol-4-yl)-3-(1-methyl-1H-pyrazol-5-yl)propanoate

Catalog ID
STL411045
SMILES COC(=O)CC(c1ccnn1C)c1c(O)n[nH]c1Cc1ccccc1

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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 C18H20N4O3 MW 340.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3/c1-22-15(8-9-19-22)13(11-16(23)25-2)17-14(20-21-18(17)24)10-12-6-4-3-5-7-12/h3-9,13H,10-11H2,1-2H3,(H2,20,21,24)
InChIKey
AIRVNEFVYHPUJT-UHFFFAOYSA-N
Synonyms
1574467-76-7
1574467767
CN1C(=CC=N1)C(CC(=O)OC)C2=C(NNC2=O)CC3=CC=CC=C3
COC(=O)CC(c1ccnn1C)c1c(O)n(nH)c1Cc1ccccc1
InChI=1SC18H20N4O3c12215(891922)13(1116(23)252)1714(202118(17)24)10126435712h3913H1011H212H3(H2202124)
methyl3(3benzyl5oxo12dihydropyrazol4yl)3(2methylpyrazol3yl)propanoate
methyl3(5benzyl3hydroxy1Hpyrazol4yl)3(1methyl1Hpyrazol5yl)propanoate
MFCD30706505
ZINC000096117883
ZINC000096117884

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Available files

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