Vitas-M small molecule compound

2-(5-methyl-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STL048353
SMILES CC1Nc2nc(nn2C(C1)c1ccccc1)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 C20H21N5O2 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2/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/h2-8,12,14-16H,9-11H2,1H3,(H,21,22,23)
InChIKey
WEJNRRKULRNDDB-UHFFFAOYSA-N
Synonyms
1008634-18-1
1008634181
2(5methyl7phenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydroisoindole13dione
2(5methyl7phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
CC1CC(N2C(=N1)N=C(N2)N3C(=O)C4CC=CCC4C3=O)C5=CC=CC=C5
InChI=1SC20H21N5O2c1121116(137324813)2519(2112)2220(2325)2417(26)149561015(14)18(24)27h28121416H911H21H3(H212223)
MFCD05692768
ZINC000005529334
ZINC000245247567

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Available files

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