Vitas-M small molecule compound
7-[4-chloro-3-(trifluoromethyl)phenyl]-2-(methylsulfanyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Catalog ID
STK790403
SMILES CSc1nn2c(n1)ncc1c2ccn(c1=O)c1ccc(c(c1)C(F)(F)F)Cl
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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 C16H9ClF3N5OS MW 411.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9ClF3N5OS/c1-27-15-22-14-21-7-9-12(25(14)23-15)4-5-24(13(9)26)8-2-3-11(17)10(6-8)16(18,19)20/h2-7H,1H3InChIKey
KQQDFKKKJVDOON-UHFFFAOYSA-NSynonyms
1158781-32-81158781328
7(4chloro3(trifluoromethyl)phenyl)2(methylsulfanyl)pyrido(34e)(124)triazolo(15a)pyrimidin6(7H)one
7(4chloro3(trifluoromethyl)phenyl)2(methylthio)pyrido(34e)(124)triazolo(15a)pyrimidin6(7H)one
CSC1=NN2C3=C(C=NC2=N1)C(=O)N(C=C3)C4=CC(=C(C=C4)Cl)C(F)(F)F
InChI=1SC16H9ClF3N5OSc127152214217912(25(14)2315)4524(13(9)26)82311(17)10(68)16(1819)20h27H1H3
MFCD13372340
ZINC000030875343
ZINC30875343
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