Vitas-M small molecule compound

methyl 2-({[7-(difluoromethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)benzoate

Catalog ID
STK960732
SMILES COC(=O)c1ccccc1NC(=O)c1nn2c(n1)nc(cc2C(F)F)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 C16H13F2N5O3 MW 361.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F2N5O3/c1-8-7-11(12(17)18)23-16(19-8)21-13(22-23)14(24)20-10-6-4-3-5-9(10)15(25)26-2/h3-7,12H,1-2H3,(H,20,24)
InChIKey
AYVJJMMCMMZNLT-UHFFFAOYSA-N
Synonyms
515848-99-4
515848994
CC1=NC2=NC(=NN2C(=C1)C(F)F)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC16H13F2N5O3c18711(12(17)18)2316(198)2113(2223)14(24)201064359(10)15(25)262h3712H12H3(H2024)
methyl2(((7(difluoromethyl)5methyl(124)triazolo(15a)pyrimidin2yl)carbonyl)amino)benzoate
METHYL2((7(DIFLUOROMETHYL)5METHYL(124)TRIAZOLO(15A)PYRIMIDINE2CARBONYL)AMINO)BENZOATE
MFCD02175775
ZINC000000815204
ZINC00815204
ZINC815204

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Available files

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