Vitas-M small molecule compound

methyl (2-bromo-6-methoxy-4-{(E)-[2-({[(4-methoxyphenyl)acetyl]amino}acetyl)hydrazinylidene]methyl}phenoxy)acetate (non-preferred name)

Catalog ID
STK102747
SMILES COC(=O)COc1c(Br)cc(cc1OC)/C=N/NC(=O)CNC(=O)Cc1ccc(cc1)OC

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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 C22H24BrN3O7 MW 522.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN3O7/c1-30-16-6-4-14(5-7-16)10-19(27)24-12-20(28)26-25-11-15-8-17(23)22(18(9-15)31-2)33-13-21(29)32-3/h4-9,11H,10,12-13H2,1-3H3,(H,24,27)(H,26,28)/b25-11+
InChIKey
OJYJJMKGPTUTSP-OPEKNORGSA-N
Synonyms

COC(=O)COc1c(Br)cc(cc1OC)C=NNC(=O)CNC(=O)Cc1ccc(cc1)OC
COC1=CC=C(C=C1)CC(=O)NCC(=O)NN=CC2=CC(=C(C(=C2)Br)OCC(=O)OC)OC
InChI=1SC22H24BrN3O7c130166414(5716)1019(27)241220(28)26251115817(23)22(18(915)312)331321(29)323h4911H101213H213H3(H2427)(H2628)b2511+
METHYL(2BROMO6METHOXY4((E)(2((((4METHOXYPHENYL)ACETYL)AMINO)ACETYL)HYDRAZINYLIDENE)METHYL)PHENOXY)ACETATE(NONPREFERREDNAME)
methyl2(2bromo6methoxy4((E)((2((2(4methoxyphenyl)acetyl)amino)acetyl)hydrazinylidene)methyl)phenoxy)acetate
METHYL2(4((1E)2(2(2(4METHOXYPHENYL)ACETYLAMINO)ACETYLAMINO)2AZAVINYL)2BROMO6METHOXYPHENOXY)ACETATE
MFCD03103194
ZINC000008722668
ZINC33923031

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Available files

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