Vitas-M small molecule compound

N-[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]-2-fluorobenzamide

Catalog ID
STK085422
SMILES CCOc1ccc(cc1)n1nc2c(n1)ccc(c2)NC(=O)c1ccccc1F

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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 C21H17FN4O2 MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN4O2/c1-2-28-16-10-8-15(9-11-16)26-24-19-12-7-14(13-20(19)25-26)23-21(27)17-5-3-4-6-18(17)22/h3-13H,2H2,1H3,(H,23,27)
InChIKey
SAVPUYAUZVAKFP-UHFFFAOYSA-N
Synonyms
352666-24-1
352666241
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=CC=C4F
CCOc1ccc(cc1)n1nc2c(n1)ccc(c2)NC(=O)c1ccccc1F
InChI=1SC21H17FN4O2c12281610815(91116)26241912714(1320(19)2526)2321(27)17534618(17)22h313H2H21H3(H2327)
MFCD01063978
N(2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5YL)2FLUOROBENZAMIDE
N(2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)2fluorobenzamide
N(2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)2FLUOROBENZAMIDE
N(2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)2FLUOROBENZAMIDE
STK085422
ZINC000000989986
ZINC00989986
ZINC989986

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Available files

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