Vitas-M small molecule compound

2-(methylsulfanyl)-5-phenyl-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine

Catalog ID
STK980393
SMILES CSc1nn2c(n1)nc(cc2C(F)(F)F)c1ccccc1

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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 C13H9F3N4S MW 310.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9F3N4S/c1-21-12-18-11-17-9(8-5-3-2-4-6-8)7-10(13(14,15)16)20(11)19-12/h2-7H,1H3
InChIKey
OKGNUWGOCBGENV-UHFFFAOYSA-N
Synonyms
654647-33-3
2(methylsulfanyl)5phenyl7(trifluoromethyl)(124)triazolo(15a)pyrimidine
2(METHYLTHIO)5PHENYL7(TRIFLUOROMETHYL)(124)TRIAZOLO(15A)PYRIMIDINE
2METHYLSULFANYL5PHENYL7(TRIFLUOROMETHYL)(124)TRIAZOLO(15A)PYRIMIDINE
654647333
CSC1=NN2C(=CC(=NC2=N1)C3=CC=CC=C3)C(F)(F)F
InChI=1SC13H9F3N4Sc121121811179(8532468)710(13(1415)16)20(11)1912h27H1H3
MFCD04050137
ZINC000001066600
ZINC01066600
ZINC1066600

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.