Vitas-M small molecule compound
(E)-1-(3,4-dimethoxyphenyl)-N-{[7-(furan-2-ylmethyl)-8,9-diphenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Catalog ID
STK725582
SMILES COc1cc(/C=N/OCc2nn3c(n2)c2c(nc3)n(c(c2c2ccccc2)c2ccccc2)Cc2ccco2)ccc1OC
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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 C34H28N6O4 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N6O4/c1-41-27-16-15-23(18-28(27)42-2)19-36-44-21-29-37-34-31-30(24-10-5-3-6-11-24)32(25-12-7-4-8-13-25)39(20-26-14-9-17-43-26)33(31)35-22-40(34)38-29/h3-19,22H,20-21H2,1-2H3/b36-19+InChIKey
LLYOGLNDXFHZRB-ODNPBWNPSA-NSynonyms
(E)1(34dimethoxyphenyl)N((7(furan2ylmethyl)89diphenyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)methanimine
(E)34dimethoxybenzaldehydeO((7(furan2ylmethyl)89diphenyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
COC1=C(C=C(C=C1)C=NOCC2=NN3C=NC4=C(C3=N2)C(=C(N4CC5=CC=CO5)C6=CC=CC=C6)C7=CC=CC=C7)OC
COc1cc(C=NOCc2nn3c(n2)c2c(nc3)n(c(c2c2ccccc2)c2ccccc2)Cc2ccco2)ccc1OC
InChI=1SC34H28N6O4c14127161523(1828(27)422)193644212937343130(24105361124)32(25127481325)39(2026149174326)33(31)352240(34)3829h31922H2021H212H3b3619+
MFCD03677125
ZINC000001875829
ZINC102647408
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