Vitas-M small molecule compound
3-(2-chloro-6-fluorophenyl)-5-methyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purine-6,8(7H)-dione
Catalog ID
STL242294
SMILES CC(CCn1c2c(=O)[nH]c(=O)n(c2n2c1nnc2c1c(F)cccc1Cl)C)C
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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 C18H18ClFN6O2 MW 404.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClFN6O2/c1-9(2)7-8-25-13-15(27)21-18(28)24(3)16(13)26-14(22-23-17(25)26)12-10(19)5-4-6-11(12)20/h4-6,9H,7-8H2,1-3H3,(H,21,27,28)InChIKey
ZZQZVYFUIOBNEH-UHFFFAOYSA-NSynonyms
921804-08-23(2chloro6fluorophenyl)5methyl9(3methylbutyl)59dihydro6H(124)triazolo(43e)purine68(7H)dione
CC(CCn1c2c(=O)(nH)c(=O)n(c2n2c1nnc2c1c(F)cccc1Cl)C)C
MFCD08933727
ZINC000010964410
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