Vitas-M small molecule compound

N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]-2-(2-fluorophenoxy)acetamide

Catalog ID
STK345381
SMILES CCc1nnc2n1nc(s2)c1ccc(cc1)CNC(=O)COc1ccccc1F

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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 C20H18FN5O2S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18FN5O2S/c1-2-17-23-24-20-26(17)25-19(29-20)14-9-7-13(8-10-14)11-22-18(27)12-28-16-6-4-3-5-15(16)21/h3-10H,2,11-12H2,1H3,(H,22,27)
InChIKey
FARCOMSZTWUPPS-UHFFFAOYSA-N
Synonyms

CCC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)CNC(=O)COC4=CC=CC=C4F
InChI=1SC20H18FN5O2Sc121723242026(17)2519(2920)149713(81014)112218(27)122816643515(16)21h310H21112H21H3(H2227)
MFCD09965073
N((4(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)2(2fluorophenoxy)acetamide
N(4(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)benzyl)2(2fluorophenoxy)acetamide
ZINC000012856975
ZINC12856975

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Available files

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