Vitas-M small molecule compound

N-(2-methoxybenzyl)-1-(methylsulfonyl)-3-(pyridin-3-yl)-1H-1,2,4-triazol-5-amine

Catalog ID
STK227733
SMILES COc1ccccc1CNc1nc(nn1S(=O)(=O)C)c1cccnc1

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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 C16H17N5O3S MW 359.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3S/c1-24-14-8-4-3-6-12(14)11-18-16-19-15(13-7-5-9-17-10-13)20-21(16)25(2,22)23/h3-10H,11H2,1-2H3,(H,18,19,20)
InChIKey
JILIUJWAWIXIBP-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1CNC2=NC(=NN2S(=O)(=O)C)C3=CN=CC=C3
InChI=1SC16H17N5O3Sc12414843612(14)1118161915(13759171013)2021(16)25(222)23h310H11H212H3(H181920)
MFCD07792152
N((2METHOXYPHENYL)METHYL)2METHYLSULFONYL5PYRIDIN3YL124TRIAZOL3AMINE
N(2METHOXYBENZYL)1(METHYLSULFONYL)3(PYRIDIN3YL)1H124TRIAZOL5AMINE
ZINC000004732613
ZINC04732613
ZINC4732613

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Available files

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