Vitas-M small molecule compound
methyl 4-{[4-bromo-3,5-bis(3-methoxyphenyl)-1H-pyrazol-1-yl]methyl}benzoate
Catalog ID
STK313627
SMILES COc1cccc(c1)c1n(Cc2ccc(cc2)C(=O)OC)nc(c1Br)c1cccc(c1)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/c1-31-21-8-4-6-19(14-21)24-23(27)25(20-7-5-9-22(15-20)32-2)29(28-24)16-17-10-12-18(13-11-17)26(30)33-3/h4-15H,16H2,1-3H3InChIKey
YPYHCQJBYJJPAT-UHFFFAOYSA-NSynonyms
1006330-50-21006330502
COC1=CC=CC(=C1)C2=C(C(=NN2CC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)OC)Br
InChI=1SC26H23BrN2O4c1312184619(1421)2423(27)25(2075922(1520)322)29(2824)1617101218(131117)26(30)333h415H16H213H3
methyl4((4bromo35bis(3methoxyphenyl)1Hpyrazol1yl)methyl)benzoate
methyl4((4bromo35bis(3methoxyphenyl)pyrazol1yl)methyl)benzoate
MFCD08551296
ZINC000013960517
ZINC13960517
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