Vitas-M small molecule compound

N-(4-ethylbenzyl)-2-(4-fluorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide

Catalog ID
STL389165
SMILES OCc1nn(nc1C(=O)NCc1ccc(cc1)CC)c1ccc(cc1)F

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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 C19H19FN4O2 MW 354.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19FN4O2/c1-2-13-3-5-14(6-4-13)11-21-19(26)18-17(12-25)22-24(23-18)16-9-7-15(20)8-10-16/h3-10,25H,2,11-12H2,1H3,(H,21,26)
InChIKey
QFORAWUESPNGDU-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)CNC(=O)C2=NN(N=C2CO)C3=CC=C(C=C3)F
InChI=1SC19H19FN4O2c12133514(6413)112119(26)1817(1225)2224(2318)169715(20)81016h31025H21112H21H3(H2126)
MFCD14814798
N((4ethylphenyl)methyl)2(4fluorophenyl)5(hydroxymethyl)triazole4carboxamide
N(4ethylbenzyl)2(4fluorophenyl)5(hydroxymethyl)2H123triazole4carboxamide
ZINC000021172886
ZINC21172886

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Available files

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