Vitas-M small molecule compound

6-methyl-2-(4-methylphenyl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrimidine-5-carbonitrile

Catalog ID
STK845373
SMILES N#CC1=C(C)NC(=NC1(C(F)(F)F)C(F)(F)F)c1ccc(cc1)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 C15H11F6N3 MW 347.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11F6N3/c1-8-3-5-10(6-4-8)12-23-9(2)11(7-22)13(24-12,14(16,17)18)15(19,20)21/h3-6H,1-2H3,(H,23,24)
InChIKey
GQTVLCXUNVMTSE-UHFFFAOYSA-N
Synonyms
577998-22-2
577998222
6methyl2(4methylphenyl)44bis(trifluoromethyl)14dihydropyrimidine5carbonitrile
6METHYL2(4METHYLPHENYL)44BIS(TRIFLUOROMETHYL)1HPYRIMIDINE5CARBONITRILE
6methyl2(ptolyl)44bis(trifluoromethyl)14dihydropyrimidine5carbonitrile
CC1=CC=C(C=C1)C2=NC(C(=C(N2)C)C#N)(C(F)(F)F)C(F)(F)F
InChI=1SC15H11F6N3c183510(648)12239(2)11(722)13(241214(1617)18)15(1920)21h36H12H3(H2324)
MFCD03941097
ZINC000020292849
ZINC20292849

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Available files

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