Vitas-M small molecule compound
ethyl 4-amino-2-[({(4Z)-6-amino-4-[(4-fluorophenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}methyl)sulfanyl]pyrimidine-5-carboxylate
Catalog ID
STL045669
SMILES CCOC(=O)c1cnc(nc1N)SCc1nc(N)[nH]/c(=N/c2ccc(cc2)F)/n1
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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 C17H17FN8O2S MW 416.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN8O2S/c1-2-28-14(27)11-7-21-17(25-13(11)19)29-8-12-23-15(20)26-16(24-12)22-10-5-3-9(18)4-6-10/h3-7H,2,8H2,1H3,(H2,19,21,25)(H3,20,22,23,24,26)InChIKey
VLJAIEKCUCADNF-UHFFFAOYSA-NSynonyms
511514-30-0511514300
CCOC(=O)c1cnc(nc1N)SCc1nc(N)(nH)c(=Nc2ccc(cc2)F)n1
MFCD03802577
ZINC000002203907
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.