Vitas-M small molecule compound

N-{1,1,1,3,3,3-hexafluoro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl}-4-methoxybenzamide

Catalog ID
STK535556
SMILES COc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1nnc(s1)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 C14H12F6N4O2S MW 414.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12F6N4O2S/c1-7-23-24-11(27-7)22-12(13(15,16)17,14(18,19)20)21-10(25)8-3-5-9(26-2)6-4-8/h3-6H,1-2H3,(H,21,25)(H,22,24)
InChIKey
HOFMLJNCXJSELR-UHFFFAOYSA-N
Synonyms

4METHOXYN(222TRIFLUORO1((5METHYL134THIADIAZOL2YL)AMINO)1(TRIFLUOROMETHYL)ETHYL)BENZAMIDE
CC1=NN=C(S1)NC(C(F)(F)F)(C(F)(F)F)NC(=O)C2=CC=C(C=C2)OC
InChI=1SC14H12F6N4O2Sc17232411(277)2212(13(1516)1714(1819)20)2110(25)8359(262)648h36H12H3(H2125)(H2224)
MFCD02944850
N(111333hexafluoro2((5methyl134thiadiazol2yl)amino)propan2yl)4methoxybenzamide
ZINC000000721245
ZINC00721245
ZINC721245

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Available files

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