Vitas-M small molecule compound
(2E)-3-{3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl}-N-[1-(4-fluorobenzyl)-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK317541
SMILES COc1ccc(cc1COc1ccc(cc1Br)Cl)/C=C/C(=O)Nc1cnn(c1)Cc1ccc(cc1)F
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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 C27H22BrClFN3O3 MW 570.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrClFN3O3/c1-35-25-9-4-18(12-20(25)17-36-26-10-6-21(29)13-24(26)28)5-11-27(34)32-23-14-31-33(16-23)15-19-2-7-22(30)8-3-19/h2-14,16H,15,17H2,1H3,(H,32,34)/b11-5+InChIKey
FFWGCXYRPGUNMP-VZUCSPMQSA-NSynonyms
515858-15-8(2E)3(3((2bromo4chlorophenoxy)methyl)4methoxyphenyl)N(1(4fluorobenzyl)1Hpyrazol4yl)prop2enamide
(E)3(3((2BROMO4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)N(1((4FLUOROPHENYL)METHYL)PYRAZOL4YL)PROP2ENAMIDE
3(3((2BROMO4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)N(1(4FLUOROBENZYL)1HPYRAZOL4YL)ACRYLAMIDE
515858158
COC1=C(C=C(C=C1)C=CC(=O)NC2=CN(N=C2)CC3=CC=C(C=C3)F)COC4=C(C=C(C=C4)Cl)Br
COc1ccc(cc1COc1ccc(cc1Br)Cl)C=CC(=O)Nc1cnn(c1)Cc1ccc(cc1)F
InChI=1SC27H22BrClFN3O3c135259418(1220(25)17362610621(29)1324(26)28)51127(34)3223143133(1623)15192722(30)8319h21416H1517H21H3(H3234)b115+
MFCD02373363
ZINC000002770156
ZINC02770156
ZINC2770156
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