Vitas-M small molecule compound

4-[(2E)-2-{5-chloro-2-[2-(2-methylphenoxy)ethoxy]benzylidene}hydrazinyl]-2,6-di(pyrrolidin-1-yl)pyrimidine

Catalog ID
STK095044
SMILES Clc1ccc(c(c1)/C=N/Nc1cc(nc(n1)N1CCCC1)N1CCCC1)OCCOc1ccccc1C

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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 C28H33ClN6O2 MW 521.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33ClN6O2/c1-21-8-2-3-9-24(21)36-16-17-37-25-11-10-23(29)18-22(25)20-30-33-26-19-27(34-12-4-5-13-34)32-28(31-26)35-14-6-7-15-35/h2-3,8-11,18-20H,4-7,12-17H2,1H3,(H,31,32,33)/b30-20+
InChIKey
DGUJKWSFMPNLJX-TWKHWXDSSA-N
Synonyms

4((2E)2(5CHLORO2(2(2METHYLPHENOXY)ETHOXY)BENZYLIDENE)HYDRAZINYL)26DI(PYRROLIDIN1YL)PYRIMIDINE
5CHLORO2(2(2METHYLPHENOXY)ETHOXY)BENZALDEHYDE(26DIPYRROLIDIN1YLPYRIMIDIN4YL)HYDRAZONE
CC1=CC=CC=C1OCCOC2=C(C=C(C=C2)Cl)C=NNC3=NC(=NC(=C3)N4CCCC4)N5CCCC5
Clc1ccc(c(c1)C=NNc1cc(nc(n1)N1CCCC1)N1CCCC1)OCCOc1ccccc1C
InChI=1SC28H33ClN6O2c121823924(21)3616173725111023(29)1822(25)203033261927(3412451334)3228(3126)3514671535h238111820H471217H21H3(H313233)b3020+
MFCD02952549
N((E)(5CHLORO2(2(2METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENEAMINO)26DIPYRROLIDIN1YLPYRIMIDIN4AMINE
STK095044
ZINC000008407792
ZINC33506954

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Available files

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