Vitas-M small molecule compound

methyl 4-{2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinyl}-4-oxobutanoate

Catalog ID
STK035345
SMILES COC(=O)CCC(=O)NNC(=O)COc1ccc(cc1Br)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 C14H17BrN2O5 MW 373.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17BrN2O5/c1-9-3-4-11(10(15)7-9)22-8-13(19)17-16-12(18)5-6-14(20)21-2/h3-4,7H,5-6,8H2,1-2H3,(H,16,18)(H,17,19)
InChIKey
BYRUUFHDTSUGGY-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)OCC(=O)NNC(=O)CCC(=O)OC)Br
COC(=O)CCC(=O)NNC(=O)COc1ccc(cc1Br)C
InChI=1SC14H17BrN2O5c193411(10(15)79)22813(19)171612(18)5614(20)212h347H568H212H3(H1618)(H1719)
METHYL3(N(2(2BROMO4METHYLPHENOXY)ACETYLAMINO)CARBAMOYL)PROPANOATE
METHYL4(2((2BROMO4METHYLPHENOXY)ACETYL)HYDRAZINYL)4OXOBUTANOATE
METHYL4(2(2(2BROMO4METHYLPHENOXY)ACETYL)HYDRAZINYL)4OXOBUTANOATE
MFCD02813752
STK035345
ZINC000005681416
ZINC05681416
ZINC5681416

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.