Vitas-M small molecule compound
4-acetyl-1-[4-bromo-1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK315236
SMILES COc1ccc(cc1)C1C(=C(C(=O)N1c1nn(cc1Br)Cc1ccc(cc1)Cl)O)C(=O)C
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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 C23H19BrClN3O4 MW 516.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrClN3O4/c1-13(29)19-20(15-5-9-17(32-2)10-6-15)28(23(31)21(19)30)22-18(24)12-27(26-22)11-14-3-7-16(25)8-4-14/h3-10,12,20,30H,11H2,1-2H3InChIKey
VPIYBNCAWUZGRB-UHFFFAOYSA-NSynonyms
1006332-26-81006332268
3acetyl1(4bromo1((4chlorophenyl)methyl)pyrazol3yl)4hydroxy2(4methoxyphenyl)2Hpyrrol5one
4acetyl1(4bromo1(4chlorobenzyl)1Hpyrazol3yl)3hydroxy5(4methoxyphenyl)15dihydro2Hpyrrol2one
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)OC)C3=NN(C=C3Br)CC4=CC=C(C=C4)Cl)O
InChI=1SC23H19BrClN3O4c113(29)1920(155917(322)10615)28(23(31)21(19)30)2218(24)1227(2622)11143716(25)8414h310122030H11H212H3
MFCD08556884
ZINC000013961512
ZINC000013961513
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