Vitas-M small molecule compound
2-{2-[({[(E)-(3,4-dimethoxyphenyl)methylidene]amino}oxy)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}ethanol
Catalog ID
STK602112
SMILES OCCn1c(C)c(c2c1ncn1c2nc(n1)CO/N=C/c1ccc(c(c1)OC)OC)C
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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 C21H24N6O4 MW 424.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N6O4/c1-13-14(2)26(7-8-28)20-19(13)21-24-18(25-27(21)12-22-20)11-31-23-10-15-5-6-16(29-3)17(9-15)30-4/h5-6,9-10,12,28H,7-8,11H2,1-4H3/b23-10+InChIKey
BFWXVLQPMKYSEZ-AUEPDCJTSA-NSynonyms
(E)34dimethoxybenzaldehydeO((7(2hydroxyethyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
2(2(((((E)(34dimethoxyphenyl)methylidene)amino)oxy)methyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin7yl)ethanol
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CON=CC4=CC(=C(C=C4)OC)OC)CCO)C
InChI=1SC21H24N6O4c11314(2)26(7828)2019(13)212418(2527(21)122220)11312310155616(293)17(915)304h569101228H7811H214H3b2310+
MFCD08744182
OCCn1c(C)c(c2c1ncn1c2nc(n1)CON=Cc1ccc(c(c1)OC)OC)C
ZINC000013623853
ZINC59721058
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