Vitas-M small molecule compound
2-{3-[7-(4-fluorophenyl)-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
STK945615
SMILES O=C1N(CCCc2nc3n(n2)cnc2c3c(C)c(n2c2ccc(cc2)F)C)C(=O)c2c1cccc2
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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 C26H21FN6O2 MW 468.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN6O2/c1-15-16(2)33(18-11-9-17(27)10-12-18)23-22(15)24-29-21(30-32(24)14-28-23)8-5-13-31-25(34)19-6-3-4-7-20(19)26(31)35/h3-4,6-7,9-12,14H,5,8,13H2,1-2H3InChIKey
XYEQCSKYVCOJGD-UHFFFAOYSA-NSynonyms
920476-78-42(3(7(4fluorophenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)propyl)1Hisoindole13(2H)dione
2(3(7(4fluorophenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)propyl)isoindoline13dione
920476784
CC1=C(N(C2=C1C3=NC(=NN3C=N2)CCCN4C(=O)C5=CC=CC=C5C4=O)C6=CC=C(C=C6)F)C
InChI=1SC26H21FN6O2c11516(2)33(1811917(27)101218)2322(15)242921(3032(24)142823)85133125(34)19634720(19)26(31)35h346791214H5813H212H3
MFCD08751218
ZINC000009420401
ZINC09420401
ZINC9420401
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