Vitas-M small molecule compound

2-(2-fluorobenzyl)-5-{[(4-methoxyphenyl)amino]methyl}-1,2-dihydro-3H-1,2,4-triazol-3-one

Catalog ID
STK695572
SMILES COc1ccc(cc1)NCc1[nH]n(c(=O)n1)Cc1ccccc1F

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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 C17H17FN4O2 MW 328.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN4O2/c1-24-14-8-6-13(7-9-14)19-10-16-20-17(23)22(21-16)11-12-4-2-3-5-15(12)18/h2-9,19H,10-11H2,1H3,(H,20,21,23)
InChIKey
VXFBXJWFOKCVIR-UHFFFAOYSA-N
Synonyms
1192657-02-5
1192657025
2((2fluorophenyl)methyl)5((4methoxyanilino)methyl)1H124triazol3one
2(2fluorobenzyl)5(((4methoxyphenyl)amino)methyl)12dihydro3H124triazol3one
2(2fluorobenzyl)5(((4methoxyphenyl)amino)methyl)1H124triazol3(2H)one
COC1=CC=C(C=C1)NCC2=NC(=O)N(N2)CC3=CC=CC=C3F
COc1ccc(cc1)NCc1(nH)n(c(=O)n1)Cc1ccccc1F
InChI=1SC17H17FN4O2c124148613(7914)1910162017(23)22(2116)1112423515(12)18h2919H1011H21H3(H202123)
MFCD16627942
ZINC000036559164
ZINC36559164

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Available files

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