Vitas-M small molecule compound
2-{3-[7-(3-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]propyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK627920
SMILES COc1cccc(c1)n1c(C)c(c2c1ncn1c2nc(n1)CCCN1C(=O)c2c(C1=O)cccc2)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 C27H24N6O3 MW 480.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N6O3/c1-16-17(2)33(18-8-6-9-19(14-18)36-3)24-23(16)25-29-22(30-32(25)15-28-24)12-7-13-31-26(34)20-10-4-5-11-21(20)27(31)35/h4-6,8-11,14-15H,7,12-13H2,1-3H3InChIKey
CQYNUYVPHRGOFM-UHFFFAOYSA-NSynonyms
951926-71-92(3(7(3methoxyphenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)propyl)1Hisoindole13(2H)dione
2(3(7(3methoxyphenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)propyl)isoindoline13dione
951926719
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CCCN4C(=O)C5=CC=CC=C5C4=O)C6=CC(=CC=C6)OC)C
InChI=1SC27H24N6O3c11617(2)33(1886919(1418)363)2423(16)252922(3032(25)152824)127133126(34)2010451121(20)27(31)35h468111415H71213H213H3
MFCD09856059
ZINC000013724646
ZINC13724646
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