Vitas-M small molecule compound
{4-[(E)-{2-[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-2-methoxyphenoxy}acetic acid
Catalog ID
STL428233
SMILES COc1cc(/C=N/Nc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OCC(=O)O
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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 C21H27N7O4 MW 441.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N7O4/c1-31-17-12-15(6-7-16(17)32-14-18(29)30)13-22-26-19-23-20(27-8-2-3-9-27)25-21(24-19)28-10-4-5-11-28/h6-7,12-13H,2-5,8-11,14H2,1H3,(H,29,30)(H,23,24,25,26)/b22-13+InChIKey
WIKKPVCGWDBGLO-LPYMAVHISA-NSynonyms
(4((E)(2(46di(pyrrolidin1yl)135triazin2yl)hydrazinylidene)methyl)2methoxyphenoxy)aceticacid
2(4((E)((46dipyrrolidin1yl135triazin2yl)hydrazinylidene)methyl)2methoxyphenoxy)aceticacid
COC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4)OCC(=O)O
COc1cc(C=NNc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OCC(=O)O
InChI=1SC21H27N7O4c131171215(6716(17)321418(29)30)132226192320(27823927)2521(2419)2810451128h671213H2581114H21H3(H2930)(H23242526)b2213+
MFCD02614868
ZINC000009310229
ZINC33670155
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