Vitas-M small molecule compound
{4-[(E)-{2-[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-2-ethoxyphenoxy}acetic acid
Catalog ID
STL428045
SMILES CCOc1cc(/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 C22H29N7O4 MW 455.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N7O4/c1-2-32-18-13-16(7-8-17(18)33-15-19(30)31)14-23-27-20-24-21(28-9-3-4-10-28)26-22(25-20)29-11-5-6-12-29/h7-8,13-14H,2-6,9-12,15H2,1H3,(H,30,31)(H,24,25,26,27)/b23-14+InChIKey
MDEJRMBINMLEEV-OEAKJJBVSA-NSynonyms
(4((E)(2(46di(pyrrolidin1yl)135triazin2yl)hydrazinylidene)methyl)2ethoxyphenoxy)aceticacid
2(4((1E)2((46DIPYRROLIDINYL(135TRIAZIN2YL))AMINO)2AZAVINYL)2ETHOXYPHENOXY)ACETICACID
2(4((E)((46dipyrrolidin1yl135triazin2yl)hydrazinylidene)methyl)2ethoxyphenoxy)aceticacid
CCOC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4)OCC(=O)O
CCOc1cc(C=NNc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OCC(=O)O
InChI=1SC22H29N7O4c1232181316(7817(18)331519(30)31)142327202421(289341028)2622(2520)2911561229h781314H2691215H21H3(H3031)(H24252627)b2314+
MFCD01963452
ZINC000006600556
ZINC33930583
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