Vitas-M small molecule compound
N-{3-chloro-5-ethoxy-4-[(2-fluorobenzyl)oxy]benzyl}-1H-1,2,4-triazol-3-amine
Catalog ID
STK511691
SMILES CCOc1cc(CNc2nc[nH]n2)cc(c1OCc1ccccc1F)Cl
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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 C18H18ClFN4O2 MW 376.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClFN4O2/c1-2-25-16-8-12(9-21-18-22-11-23-24-18)7-14(19)17(16)26-10-13-5-3-4-6-15(13)20/h3-8,11H,2,9-10H2,1H3,(H2,21,22,23,24)InChIKey
ITBIBEUJDCCQFJ-UHFFFAOYSA-NSynonyms
CCOC1=C(C(=CC(=C1)CNC2=NC=NN2)Cl)OCC3=CC=CC=C3F
CCOc1cc(CNc2nc(nH)n2)cc(c1OCc1ccccc1F)Cl
InChI=1SC18H18ClFN4O2c122516812(921182211232418)714(19)17(16)261013534615(13)20h3811H2910H21H3(H221222324)
MFCD07611057
N((3chloro5ethoxy4((2fluorophenyl)methoxy)phenyl)methyl)1H124triazol5amine
N(3chloro5ethoxy4((2fluorobenzyl)oxy)benzyl)1H124triazol3amine
ZINC000020175725
ZINC20175725
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