Vitas-M small molecule compound
8-hydroxy-3-(4-methoxyphenyl)-5-methyl-9-(propan-2-yl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purin-6-one
Catalog ID
STL158678
SMILES COc1ccc(cc1)c1nnc2n1c1c(n2C(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 C17H18N6O3 MW 354.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6O3/c1-9(2)22-12-14(24)18-17(25)21(3)15(12)23-13(19-20-16(22)23)10-5-7-11(26-4)8-6-10/h5-9H,1-4H3,(H,18,24,25)InChIKey
KUJHRNLPJZVRSW-UHFFFAOYSA-NSynonyms
921530-80-53(4METHOXYPHENYL)5METHYL9(METHYLETHYL)579TRIHYDRO124TRIAZOLO(34I)PURINE68DIONE
8(4methoxyphenyl)1methyl5propan2ylpurino(89c)(124)triazole24dione
8hydroxy3(4methoxyphenyl)5methyl9(propan2yl)59dihydro6H(124)triazolo(43e)purin6one
921530805
9ISOPROPYL3(4METHOXYPHENYL)5METHYL5H(124)TRIAZOLO(43E)PURINE68(7H9H)DIONE
CC(C)N1C2=C(N(C(=O)NC2=O)C)N3C1=NN=C3C4=CC=C(C=C4)OC
InChI=1SC17H18N6O3c19(2)221214(24)1817(25)21(3)15(12)2313(192016(22)23)105711(264)8610h59H14H3(H182425)
MFCD20758421
ZINC000010963733
ZINC10963733
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