Vitas-M small molecule compound
2-[(2E)-2-{3-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}hydrazinyl]-4,6-di(piperidin-1-yl)-1,3,5-triazine
Catalog ID
STL427778
SMILES COc1cc(/C=N/Nc2nc(nc(n2)N2CCCCC2)N2CCCCC2)ccc1OCc1ccc(cc1)[N+](=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 C28H34N8O4 MW 546.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N8O4/c1-39-25-18-22(10-13-24(25)40-20-21-8-11-23(12-9-21)36(37)38)19-29-33-26-30-27(34-14-4-2-5-15-34)32-28(31-26)35-16-6-3-7-17-35/h8-13,18-19H,2-7,14-17,20H2,1H3,(H,30,31,32,33)/b29-19+InChIKey
MROLUQNWGGTXLZ-VUTHCHCSSA-NSynonyms
2((2E)2(3methoxy4((4nitrobenzyl)oxy)benzylidene)hydrazinyl)46di(piperidin1yl)135triazine
COC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCCC3)N4CCCCC4)OCC5=CC=C(C=C5)(N+)(=O)(O)
COc1cc(C=NNc2nc(nc(n2)N2CCCCC2)N2CCCCC2)ccc1OCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC28H34N8O4c139251822(101324(25)40202181123(12921)36(37)38)192933263027(34144251534)3228(3126)35166371735h8131819H27141720H21H3(H30313233)b2919+
MFCD00763544
N((E)(3METHOXY4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)46DI(PIPERIDIN1YL)135TRIAZIN2AMINE
ZINC000008872056
ZINC103317411
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