Vitas-M small molecule compound
2-{1-[7-(3-methoxyphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]ethyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK945196
SMILES COc1cccc(c1)n1c(C)c(c2c1ncn1c2nc(n1)C(N1C(=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 C26H22N6O3 MW 466.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N6O3/c1-14-15(2)31(17-8-7-9-18(12-17)35-4)23-21(14)24-28-22(29-30(24)13-27-23)16(3)32-25(33)19-10-5-6-11-20(19)26(32)34/h5-13,16H,1-4H3InChIKey
DFNQSEPVRHBBEE-UHFFFAOYSA-NSynonyms
1031611-48-91031611489
2(1(7(3methoxyphenyl)89dimethyl7Hpyrrolo(32e)(124)triazolo(15c)pyrimidin2yl)ethyl)1Hisoindole13(2H)dione
CC1=C(N(C2=C1C3=NC(=NN3C=N2)C(C)N4C(=O)C5=CC=CC=C5C4=O)C6=CC(=CC=C6)OC)C
InChI=1SC26H22N6O3c11415(2)31(1787918(1217)354)2321(14)242822(2930(24)132723)16(3)3225(33)1910561120(19)26(32)34h51316H14H3
MFCD18180541
ZINC000021801304
ZINC000021801308
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