Vitas-M small molecule compound
4-[(E)-{2-[4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-2-ethoxyphenyl furan-2-carboxylate
Catalog ID
STL427875
SMILES CCOc1cc(/C=N/Nc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OC(=O)c1ccco1
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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 C25H29N7O4 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N7O4/c1-2-34-21-16-18(9-10-19(21)36-22(33)20-8-7-15-35-20)17-26-30-23-27-24(31-11-3-4-12-31)29-25(28-23)32-13-5-6-14-32/h7-10,15-17H,2-6,11-14H2,1H3,(H,27,28,29,30)/b26-17+InChIKey
LTPKWRICMQAIAE-YZSQISJMSA-NSynonyms
(4((E)((46dipyrrolidin1yl135triazin2yl)hydrazinylidene)methyl)2ethoxyphenyl)furan2carboxylate
4((E)(2(46di(pyrrolidin1yl)135triazin2yl)hydrazinylidene)methyl)2ethoxyphenylfuran2carboxylate
CCOC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4)OC(=O)C5=CC=CO5
CCOc1cc(C=NNc2nc(nc(n2)N2CCCC2)N2CCCC2)ccc1OC(=O)c1ccco1
InChI=1SC25H29N7O4c1234211618(91019(21)3622(33)2087153520)172630232724(3111341231)2925(2823)3213561432h7101517H261114H21H3(H27282930)b2617+
MFCD01026953
ZINC000009296454
ZINC33469307
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