Vitas-M small molecule compound
4-{(E)-[2-({[(3,4-dimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}phenyl 4-bromobenzoate (non-preferred name)
Catalog ID
STK668974
SMILES COc1cc(ccc1OC)C(=O)NCC(=O)N/N=C/c1ccc(cc1)OC(=O)c1ccc(cc1)Br
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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 C25H22BrN3O6 MW 540.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN3O6/c1-33-21-12-7-18(13-22(21)34-2)24(31)27-15-23(30)29-28-14-16-3-10-20(11-4-16)35-25(32)17-5-8-19(26)9-6-17/h3-14H,15H2,1-2H3,(H,27,31)(H,29,30)/b28-14+InChIKey
AYVUOTZIVWVLAP-CCVNUDIWSA-NSynonyms
(4((E)((2((34dimethoxybenzoyl)amino)acetyl)hydrazinylidene)methyl)phenyl)4bromobenzoate
4((2(2(34DIMETHOXYBENZAMIDO)ACETYL)HYDRAZONO)METHYL)PHENYL4BROMOBENZOATE
4((E)(2((((34dimethoxyphenyl)carbonyl)amino)acetyl)hydrazinylidene)methyl)phenyl4bromobenzoate(nonpreferredname)
COC1=C(C=C(C=C1)C(=O)NCC(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)OC
COc1cc(ccc1OC)C(=O)NCC(=O)NN=Cc1ccc(cc1)OC(=O)c1ccc(cc1)Br
InChI=1SC25H22BrN3O6c1332112718(1322(21)342)24(31)271523(30)2928141631020(11416)3525(32)175819(26)9617h314H15H212H3(H2731)(H2930)b2814+
MFCD00322781
ZINC000002565234
ZINC102772979
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