Vitas-M small molecule compound
4-[(E)-{2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]-2-ethoxyphenyl 4-fluorobenzoate
Catalog ID
STK097846
SMILES CCOc1cc(/C=N/Nc2nc(nc(n2)N2CCCCC2)N2CCCCC2)ccc1OC(=O)c1ccc(cc1)F
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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 C29H34FN7O3 MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34FN7O3/c1-2-39-25-19-21(9-14-24(25)40-26(38)22-10-12-23(30)13-11-22)20-31-35-27-32-28(36-15-5-3-6-16-36)34-29(33-27)37-17-7-4-8-18-37/h9-14,19-20H,2-8,15-18H2,1H3,(H,32,33,34,35)/b31-20+InChIKey
SCNFWARTMRADCI-AJBULDERSA-NSynonyms
(4((E)((46DI(PIPERIDIN1YL)135TRIAZIN2YL)HYDRAZINYLIDENE)METHYL)2ETHOXYPHENYL)4FLUOROBENZOATE
4((E)(2(46DI(PIPERIDIN1YL)135TRIAZIN2YL)HYDRAZINYLIDENE)METHYL)2ETHOXYPHENYL4FLUOROBENZOATE
CCOC1=C(C=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCCC3)N4CCCCC4)OC(=O)C5=CC=C(C=C5)F
CCOc1cc(C=NNc2nc(nc(n2)N2CCCCC2)N2CCCCC2)ccc1OC(=O)c1ccc(cc1)F
InChI=1SC29H34FN7O3c1239251921(91424(25)4026(38)22101223(30)131122)203135273228(36155361636)3429(3327)37177481837h9141920H281518H21H3(H32333435)b3120+
MFCD00610344
STK097846
ZINC000008872292
ZINC101500054
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