Vitas-M small molecule compound
(2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STL400481
SMILES COc1ccc(cc1COc1ccc(cc1)Br)/C=C/C(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl
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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 C29H26BrClFN3O3 MW 598.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26BrClFN3O3/c1-18-29(19(2)35(34-18)16-24-25(31)5-4-6-26(24)32)33-28(36)14-8-20-7-13-27(37-3)21(15-20)17-38-23-11-9-22(30)10-12-23/h4-15H,16-17H2,1-3H3,(H,33,36)/b14-8+InChIKey
OKMBNAUSFZVTNB-RIYZIHGNSA-NSynonyms
515857-48-4(2E)3(3((4bromophenoxy)methyl)4methoxyphenyl)N(1(2chloro6fluorobenzyl)35dimethyl1Hpyrazol4yl)prop2enamide
(E)3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)N(1((2CHLORO6FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)PROP2ENAMIDE
3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)N(1(2CHLORO6FLUOROBENZYL)35DIMETHYL1HPYRAZOL4YL)ACRYLAMIDE
515857484
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)F)C)NC(=O)C=CC3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)Br
COc1ccc(cc1COc1ccc(cc1)Br)C=CC(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl
InChI=1SC29H26BrClFN3O3c11829(19(2)35(3418)162425(31)54626(24)32)3328(36)1482071327(373)21(1520)17382311922(30)101223h415H1617H213H3(H3336)b148+
MFCD02243876
ZINC000002115308
ZINC02115308
ZINC2115308
Check stock
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Check stock on Vitas-MAvailable files
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