Vitas-M small molecule compound
N-(2-bromo-4,5-dimethylphenyl)-2-{4-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-ethoxyphenoxy}acetamide
Catalog ID
STL383159
SMILES CCOc1cc(/C=N/NC(=S)N)ccc1OCC(=O)Nc1cc(C)c(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 C20H23BrN4O3S MW 479.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN4O3S/c1-4-27-18-9-14(10-23-25-20(22)29)5-6-17(18)28-11-19(26)24-16-8-13(3)12(2)7-15(16)21/h5-10H,4,11H2,1-3H3,(H,24,26)(H3,22,25,29)/b23-10+InChIKey
HEWSBPLYECAGIZ-AUEPDCJTSA-NSynonyms
2(4(2(AMINOCARBOTHIOYL)CARBOHYDRAZONOYL)2ETHOXYPHENOXY)N(2BROMO45DIMETHYLPHENYL)ACETAMIDE
CCOC1=C(C=CC(=C1)C=NNC(=S)N)OCC(=O)NC2=C(C=C(C(=C2)C)C)Br
CCOc1cc(C=NNC(=S)N)ccc1OCC(=O)Nc1cc(C)c(cc1Br)C
InChI=1SC20H23BrN4O3Sc142718914(10232520(22)29)5617(18)281119(26)2416813(3)12(2)715(16)21h510H411H213H3(H2426)(H3222529)b2310+
MFCD03236085
N(2bromo45dimethylphenyl)2(4((E)(2carbamothioylhydrazinylidene)methyl)2ethoxyphenoxy)acetamide
N(2BROMO45DIMETHYLPHENYL)2(4((E)(CARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)2ETHOXYPHENOXY)ACETAMIDE
ZINC000000694332
ZINC33335236
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