Vitas-M small molecule compound
2-[5-hydroxy-2-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK599194
SMILES O=C1C2CCCCC2C(=O)N1c1cc(O)nc2n1nc(n2)CCc1ccccc1
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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 C21H21N5O3 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O3/c27-17-12-18(25-19(28)14-8-4-5-9-15(14)20(25)29)26-21(23-17)22-16(24-26)11-10-13-6-2-1-3-7-13/h1-3,6-7,12,14-15H,4-5,8-11H2,(H,22,23,24,27)InChIKey
PYMJPLBITRWPEX-UHFFFAOYSA-NSynonyms
879457-64-42(5hydroxy2(2phenylethyl)(124)triazolo(15a)pyrimidin7yl)hexahydro1Hisoindole13(2H)dione
2(5oxo2(2phenylethyl)1H(124)triazolo(15a)pyrimidin7yl)3a45677ahexahydroisoindole13dione
879457644
C1CCC2C(C1)C(=O)N(C2=O)C3=CC(=O)N=C4N3NC(=N4)CCC5=CC=CC=C5
InChI=1SC21H21N5O3c27171218(2519(28)14845915(14)20(25)29)2621(2317)2216(2426)1110136213713h1367121415H45811H2(H22232427)
MFCD07205315
ZINC000018020791
ZINC000101344616
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