Vitas-M small molecule compound
2-[(2E)-2-{3-bromo-5-ethoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}hydrazinyl]-4,6-di(pyrrolidin-1-yl)-1,3,5-triazine
Catalog ID
STK037794
SMILES CCOc1cc(/C=N/Nc2nc(nc(n2)N2CCCC2)N2CCCC2)cc(c1OCCOc1ccc(cc1)C)Br
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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 C29H36BrN7O3 MW 610.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36BrN7O3/c1-3-38-25-19-22(18-24(30)26(25)40-17-16-39-23-10-8-21(2)9-11-23)20-31-35-27-32-28(36-12-4-5-13-36)34-29(33-27)37-14-6-7-15-37/h8-11,18-20H,3-7,12-17H2,1-2H3,(H,32,33,34,35)/b31-20+InChIKey
NFBSFPAZIGMJEI-AJBULDERSA-NSynonyms
2((2E)2(3BROMO5ETHOXY4(2(4METHYLPHENOXY)ETHOXY)BENZYLIDENE)HYDRAZINYL)46DI(PYRROLIDIN1YL)135TRIAZINE
3BROMO5ETHOXY4(2(4METHYLPHENOXY)ETHOXY)BENZALDEHYDE(46DIPYRROLIDIN1YL135TRIAZIN2YL)HYDRAZONE
CCOC1=C(C(=CC(=C1)C=NNC2=NC(=NC(=N2)N3CCCC3)N4CCCC4)Br)OCCOC5=CC=C(C=C5)C
CCOc1cc(C=NNc2nc(nc(n2)N2CCCC2)N2CCCC2)cc(c1OCCOc1ccc(cc1)C)Br
InChI=1SC29H36BrN7O3c1338251922(1824(30)26(25)401716392310821(2)91123)203135273228(3612451336)3429(3327)3714671537h8111820H371217H212H3(H32333435)b3120+
MFCD02950953
N((E)(3bromo5ethoxy4(2(4methylphenoxy)ethoxy)phenyl)methylideneamino)46dipyrrolidin1yl135triazin2amine
STK037794
ZINC000008492975
ZINC101423815
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