Vitas-M small molecule compound
2-[7-(4-methoxyphenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK652133
SMILES COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)N1C(=O)c2c(C1=O)cccc2)c1ccccc1
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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 C26H19N5O3 MW 449.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N5O3/c1-34-18-13-11-17(12-14-18)22-15-21(16-7-3-2-4-8-16)27-25-28-26(29-31(22)25)30-23(32)19-9-5-6-10-20(19)24(30)33/h2-15,22H,1H3,(H,27,28,29)InChIKey
LOEFIAJJJUQTND-UHFFFAOYSA-NSynonyms
836650-26-12(7(4METHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)ISOINDOLE13DIONE
2(7(4methoxyphenyl)5phenyl37dihydro(124)triazolo(15a)pyrimidin2yl)1Hisoindole13(2H)dione
836650261
COC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)N4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6
COc1ccc(cc1)C1C=C(N=c2n1nc((nH)2)N1C(=O)c2c(C1=O)cccc2)c1ccccc1
InChI=1SC26H19N5O3c13418131117(121418)221521(167324816)27252826(2931(22)25)3023(32)199561020(19)24(30)33h21522H1H3(H272829)
MFCD18166224
ZINC000101017536
ZINC000101017541
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