Vitas-M small molecule compound
2-(5-methyl-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK660418
SMILES CC1=CC(c2ccccc2)n2c(=N1)[nH]c(n2)N1C(=O)C2C(C1=O)CC=CC2
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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 C20H19N5O2 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2/c1-12-11-16(13-7-3-2-4-8-13)25-19(21-12)22-20(23-25)24-17(26)14-9-5-6-10-15(14)18(24)27/h2-8,11,14-16H,9-10H2,1H3,(H,21,22,23)InChIKey
NSKQPWDRULQQDX-UHFFFAOYSA-NSynonyms
1005103-58-11005103581
2(5METHYL7PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)3A477ATETRAHYDROISOINDOLE13DIONE
2(5methyl7phenyl37dihydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
CC1=CC(c2ccccc2)n2c(=N1)(nH)c(n2)N1C(=O)C2C(C1=O)CC=CC2
CC1=CC(N2C(=N1)N=C(N2)N3C(=O)C4CC=CCC4C3=O)C5=CC=CC=C5
InChI=1SC20H19N5O2c1121116(137324813)2519(2112)2220(2325)2417(26)149561015(14)18(24)27h28111416H910H21H3(H212223)
MFCD18169052
ZINC000100906902
ZINC000245256111
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