Vitas-M small molecule compound
2-[(2E)-2-(3-bromo-4-{2-[(3,5-dimethylphenyl)amino]-2-oxoethoxy}-5-ethoxybenzylidene)hydrazinyl]-N-(3,4-dimethylphenyl)-2-oxoacetamide
Catalog ID
STK070054
SMILES CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(c(c2)C)C)cc(c1OCC(=O)Nc1cc(C)cc(c1)C)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 C29H31BrN4O5 MW 595.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31BrN4O5/c1-6-38-25-14-21(15-31-34-29(37)28(36)33-22-8-7-19(4)20(5)12-22)13-24(30)27(25)39-16-26(35)32-23-10-17(2)9-18(3)11-23/h7-15H,6,16H2,1-5H3,(H,32,35)(H,33,36)(H,34,37)/b31-15+InChIKey
OROUXOANKLLEMD-IBBHUPRXSA-NSynonyms
2((2E)2(3BROMO4(2((35DIMETHYLPHENYL)AMINO)2OXOETHOXY)5ETHOXYBENZYLIDENE)HYDRAZINYL)N(34DIMETHYLPHENYL)2OXOACETAMIDE
CCOC1=C(C(=CC(=C1)C=NNC(=O)C(=O)NC2=CC(=C(C=C2)C)C)Br)OCC(=O)NC3=CC(=CC(=C3)C)C
CCOc1cc(C=NNC(=O)C(=O)Nc2ccc(c(c2)C)C)cc(c1OCC(=O)Nc1cc(C)cc(c1)C)Br
InChI=1SC29H31BrN4O5c1638251421(15313429(37)28(36)33228719(4)20(5)1222)1324(30)27(25)391626(35)32231017(2)918(3)1123h715H616H215H3(H3235)(H3336)(H3437)b3115+
MFCD04590707
N((E)(3bromo4(2(35dimethylanilino)2oxoethoxy)5ethoxyphenyl)methylideneamino)N(34dimethylphenyl)oxamide
STK070054
ZINC000097958919
ZINC101469188
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