Vitas-M small molecule compound
4-[1-(5-benzyl-3-hydroxy-1H-pyrazol-4-yl)-3-methoxy-3-oxopropyl]benzoic acid
Catalog ID
STL541713
SMILES COC(=O)CC(c1c([nH]nc1O)Cc1ccccc1)c1ccc(cc1)C(=O)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 C21H20N2O5 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O5/c1-28-18(24)12-16(14-7-9-15(10-8-14)21(26)27)19-17(22-23-20(19)25)11-13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3,(H,26,27)(H2,22,23,25)InChIKey
OZBVDCMBJLXETK-UHFFFAOYSA-NSynonyms
1574320-97-01574320970
4(1(3benzyl5oxo12dihydropyrazol4yl)3methoxy3oxopropyl)benzoicacid
4(1(5benzyl3hydroxy1Hpyrazol4yl)3methoxy3oxopropyl)benzoicacid
4(1(5BENZYL3OXO23DIHYDRO1HPYRAZOL4YL)3METHOXY3OXOPROPYL)BENZOICACID
71825689
InChI=1SC21H20N2O5c12818(24)1216(147915(10814)21(26)27)1917(222320(19)25)11135324613h21016H1112H21H3(H2627)(H2222325)
MFCD31755418
ZINC000096116304
ZINC000096116305
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