Vitas-M small molecule compound
4-[(E)-{2-[(5-bromopyridin-3-yl)carbonyl]hydrazinylidene}methyl]-2-methoxyphenyl 4-methylbenzoate
Catalog ID
STK978043
SMILES COc1cc(/C=N/NC(=O)c2cncc(c2)Br)ccc1OC(=O)c1ccc(cc1)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 C22H18BrN3O4 MW 468.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3O4/c1-14-3-6-16(7-4-14)22(28)30-19-8-5-15(9-20(19)29-2)11-25-26-21(27)17-10-18(23)13-24-12-17/h3-13H,1-2H3,(H,26,27)/b25-11+InChIKey
RJSCZDHBJUUTEF-OPEKNORGSA-NSynonyms
(4((E)((5bromopyridine3carbonyl)hydrazinylidene)methyl)2methoxyphenyl)4methylbenzoate
4((E)(2((5bromopyridin3yl)carbonyl)hydrazinylidene)methyl)2methoxyphenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC(=CN=C3)Br)OC
COc1cc(C=NNC(=O)c2cncc(c2)Br)ccc1OC(=O)c1ccc(cc1)C
InChI=1SC22H18BrN3O4c1143616(7414)22(28)30198515(920(19)292)11252621(27)171018(23)13241217h313H12H3(H2627)b2511+
MFCD18181189
ZINC000044950388
ZINC102986821
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