Vitas-M small molecule compound
2-[7-(2-chlorophenyl)-5-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
STL238216
SMILES O=C1C2CC=CCC2C(=O)N1c1nc2n(n1)C(CC(N2)c1ccccc1)c1ccccc1Cl
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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 C25H22ClN5O2 MW 459.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O2/c26-19-13-7-6-12-18(19)21-14-20(15-8-2-1-3-9-15)27-24-28-25(29-31(21)24)30-22(32)16-10-4-5-11-17(16)23(30)33/h1-9,12-13,16-17,20-21H,10-11,14H2,(H,27,28,29)InChIKey
HNDUBZLSTYITSF-UHFFFAOYSA-NSynonyms
1024563-10-71024563107
2(7(2chlorophenyl)5phenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydroisoindole13dione
2(7(2chlorophenyl)5phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
C1C=CCC2C1C(=O)N(C2=O)C3=NC4=NC(CC(N4N3)C5=CC=CC=C5Cl)C6=CC=CC=C6
InChI=1SC25H22ClN5O2c261913761218(19)211420(158213915)27242825(2931(21)24)3022(32)1610451117(16)23(30)33h19121316172021H101114H2(H272829)
MFCD04184884
ZINC000009087102
ZINC000009184872
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