Vitas-M small molecule compound
8-hydroxy-3-(4-methoxyphenyl)-5-methyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purin-6-one
Catalog ID
STL242251
SMILES COc1ccc(cc1)c1nnc2n1c1c(n2CCC(C)C)c(O)nc(=O)n1C
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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 C19H22N6O3 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O3/c1-11(2)9-10-24-14-16(26)20-19(27)23(3)17(14)25-15(21-22-18(24)25)12-5-7-13(28-4)8-6-12/h5-8,11H,9-10H2,1-4H3,(H,20,26,27)InChIKey
GIFXXWCRXZDIOA-UHFFFAOYSA-NSynonyms
923234-14-48(4methoxyphenyl)1methyl5(3methylbutyl)purino(89c)(124)triazole24dione
8hydroxy3(4methoxyphenyl)5methyl9(3methylbutyl)59dihydro6H(124)triazolo(43e)purin6one
923234144
9ISOPENTYL3(4METHOXYPHENYL)5METHYL5H(124)TRIAZOLO(43E)PURINE68(7H9H)DIONE
CC(C)CCN1C2=C(N(C(=O)NC2=O)C)N3C1=NN=C3C4=CC=C(C=C4)OC
InChI=1SC19H22N6O3c111(2)910241416(26)2019(27)23(3)17(14)2515(212218(24)25)125713(284)8612h5811H910H214H3(H202627)
MFCD24859234
ZINC000009827681
ZINC09827681
ZINC9827681
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