Vitas-M small molecule compound
2-{[8,9-dimethyl-7-(2-methylpropyl)-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK945609
SMILES CC(Cn1c(C)c(c2c1ncn1c2nc(n1)CN1C(=O)c2c(C1=O)cccc2)C)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 C22H22N6O2 MW 402.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2/c1-12(2)9-26-14(4)13(3)18-19(26)23-11-28-20(18)24-17(25-28)10-27-21(29)15-7-5-6-8-16(15)22(27)30/h5-8,11-12H,9-10H2,1-4H3InChIKey
NWHDRLNIZHZFLI-UHFFFAOYSA-NSynonyms
921132-82-32((7isobutyl89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)isoindoline13dione
2((89dimethyl7(2methylpropyl)7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)methyl)1Hisoindole13(2H)dione
921132823
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CN4C(=O)C5=CC=CC=C5C4=O)CC(C)C)C
InChI=1SC22H22N6O2c112(2)92614(4)13(3)1819(26)23112820(18)2417(2528)102721(29)15756816(15)22(27)30h581112H910H214H3
MFCD08748034
ZINC000013627504
ZINC13627504
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