Vitas-M small molecule compound
methyl 3-{[4-bromo-3,5-bis(4-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Catalog ID
STL403157
SMILES COc1ccc(cc1)c1n(Cc2cccc(c2)C(=O)OC)nc(c1Br)c1ccc(cc1)OC
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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 C26H23BrN2O4 MW 507.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O4/c1-31-21-11-7-18(8-12-21)24-23(27)25(19-9-13-22(32-2)14-10-19)29(28-24)16-17-5-4-6-20(15-17)26(30)33-3/h4-15H,16H2,1-3H3InChIKey
CTTKVWBNSKRSPZ-UHFFFAOYSA-NSynonyms
1006330-40-01006330400
COC1=CC=C(C=C1)C2=C(C(=NN2CC3=CC=CC(=C3)C(=O)OC)C4=CC=C(C=C4)OC)Br
InChI=1SC26H23BrN2O4c1312111718(81221)2423(27)25(1991322(322)141019)29(2824)161754620(1517)26(30)333h415H16H213H3
methyl3((4bromo35bis(4methoxyphenyl)1Hpyrazol1yl)methyl)benzoate
methyl3((4bromo35bis(4methoxyphenyl)pyrazol1yl)methyl)benzoate
MFCD08551267
ZINC000022831270
ZINC22831270
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