Vitas-M small molecule compound
2-{1-[7-(4-fluorophenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]-2-methylpropyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK945639
SMILES CC(C(N1C(=O)c2c(C1=O)cccc2)c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccc(cc1)F)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 C27H23FN6O2 MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN6O2/c1-14(2)22(34-26(35)19-7-5-6-8-20(19)27(34)36)23-30-25-21-15(3)16(4)33(18-11-9-17(28)10-12-18)24(21)29-13-32(25)31-23/h5-14,22H,1-4H3InChIKey
FGUIHLLRRCOGAR-UHFFFAOYSA-NSynonyms
2(1(7(4fluorophenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)2methylpropyl)1Hisoindole13(2H)dione
CC1=C(N(C2=C1C3=NC(=NN3C=N2)C(C(C)C)N4C(=O)C5=CC=CC=C5C4=O)C6=CC=C(C=C6)F)C
InChI=1SC27H23FN6O2c114(2)22(3426(35)19756820(19)27(34)36)2330252115(3)16(4)33(1811917(28)101218)24(21)291332(25)3123h51422H14H3
MFCD14830773
ZINC000015842307
ZINC000015842309
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