Vitas-M small molecule compound
(2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK317515
SMILES COc1ccc(cc1COc1ccc(cc1)Br)/C=C/C(=O)Nc1c(C)nn(c1C)Cc1ccccc1C
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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 C30H30BrN3O3 MW 560.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30BrN3O3/c1-20-7-5-6-8-24(20)18-34-22(3)30(21(2)33-34)32-29(35)16-10-23-9-15-28(36-4)25(17-23)19-37-27-13-11-26(31)12-14-27/h5-17H,18-19H2,1-4H3,(H,32,35)/b16-10+InChIKey
VSEZALPWHYPSGS-MHWRWJLKSA-NSynonyms
515857-57-5(2E)3(3((4bromophenoxy)methyl)4methoxyphenyl)N(35dimethyl1(2methylbenzyl)1Hpyrazol4yl)prop2enamide
(E)3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)N(35DIMETHYL1((2METHYLPHENYL)METHYL)PYRAZOL4YL)PROP2ENAMIDE
3(3((4BROMOPHENOXY)METHYL)4METHOXYPHENYL)N(35DIMETHYL1(2METHYLBENZYL)1HPYRAZOL4YL)ACRYLAMIDE
515857575
CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C=CC3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)Br)C
COc1ccc(cc1COc1ccc(cc1)Br)C=CC(=O)Nc1c(C)nn(c1C)Cc1ccccc1C
InChI=1SC30H30BrN3O3c120756824(20)183422(3)30(21(2)3334)3229(35)16102391528(364)25(1723)193727131126(31)121427h517H1819H214H3(H3235)b1610+
MFCD02243911
ZINC000002115280
ZINC02115280
ZINC2115280
Check stock
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Check stock on Vitas-MAvailable files
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