Vitas-M small molecule compound
2-[5-(4-methylphenyl)-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
STL239701
SMILES Cc1ccc(cc1)C1Nc2nc(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 C26H25N5O2 MW 439.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O2/c1-16-11-13-17(14-12-16)21-15-22(18-7-3-2-4-8-18)31-25(27-21)28-26(29-31)30-23(32)19-9-5-6-10-20(19)24(30)33/h2-8,11-14,19-22H,9-10,15H2,1H3,(H,27,28,29)InChIKey
OCUDQRFWECVJDI-UHFFFAOYSA-NSynonyms
1024577-52-31024577523
2(5(4methylphenyl)7phenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydroisoindole13dione
2(5(4methylphenyl)7phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
2(7phenyl5(ptolyl)4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
CC1=CC=C(C=C1)C2CC(N3C(=N2)N=C(N3)N4C(=O)C5CC=CCC5C4=O)C6=CC=CC=C6
InChI=1SC26H25N5O2c116111317(141216)211522(187324818)3125(2721)2826(2931)3023(32)199561020(19)24(30)33h2811141922H91015H21H3(H272829)
MFCD04187989
ZINC000009185472
ZINC000248097359
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