Vitas-M small molecule compound

3-{[(3-chlorophenyl)amino]methyl}-1-[4-(trifluoromethoxy)benzyl]-1H-1,2,4-triazol-5-ol

Catalog ID
STL159140
SMILES Clc1cccc(c1)NCc1nn(c(n1)O)Cc1ccc(cc1)OC(F)(F)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 C17H14ClF3N4O2 MW 398.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClF3N4O2/c18-12-2-1-3-13(8-12)22-9-15-23-16(26)25(24-15)10-11-4-6-14(7-5-11)27-17(19,20)21/h1-8,22H,9-10H2,(H,23,24,26)
InChIKey
HQPXCONBSMOABX-UHFFFAOYSA-N
Synonyms
1310938-43-2
1310938432
3(((3chlorophenyl)amino)methyl)1(4(trifluoromethoxy)benzyl)1H124triazol5ol
5((3chloroanilino)methyl)2((4(trifluoromethoxy)phenyl)methyl)1H124triazol3one
C1=CC(=CC(=C1)Cl)NCC2=NC(=O)N(N2)CC3=CC=C(C=C3)OC(F)(F)F
InChI=1SC17H14ClF3N4O2c181221313(812)229152316(26)25(2415)10114614(7511)2717(1920)21h1822H910H2(H232426)
MFCD20758592
ZINC000071282990
ZINC71282990

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Available files

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