Vitas-M small molecule compound

methyl 4-[(E)-{2-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]benzoate

Catalog ID
STL427991
SMILES COC(=O)c1ccc(cc1)/C=N/Nc1nc(nc(n1)N1CCOCC1)N1CCOCC1

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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 C20H25N7O4 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N7O4/c1-29-17(28)16-4-2-15(3-5-16)14-21-25-18-22-19(26-6-10-30-11-7-26)24-20(23-18)27-8-12-31-13-9-27/h2-5,14H,6-13H2,1H3,(H,22,23,24,25)/b21-14+
InChIKey
HNZPBOSMQIQMML-KGENOOAVSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)C=NNC2=NC(=NC(=N2)N3CCOCC3)N4CCOCC4
COC(=O)c1ccc(cc1)C=NNc1nc(nc(n1)N1CCOCC1)N1CCOCC1
InChI=1SC20H25N7O4c12917(28)164215(3516)142125182219(266103011726)2420(2318)278123113927h2514H613H21H3(H22232425)b2114+
methyl4((E)((46dimorpholin4yl135triazin2yl)hydrazinylidene)methyl)benzoate
methyl4((E)(2(46di(morpholin4yl)135triazin2yl)hydrazinylidene)methyl)benzoate
MFCD00324383
ZINC000009296503
ZINC35253818

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.