Vitas-M small molecule compound
3-{[(4-bromophenyl)amino]methyl}-1-(3-fluorobenzyl)-1H-1,2,4-triazol-5-ol
Catalog ID
STL157082
SMILES Brc1ccc(cc1)NCc1nn(c(n1)O)Cc1cccc(c1)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 C16H14BrFN4O MW 377.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrFN4O/c17-12-4-6-14(7-5-12)19-9-15-20-16(23)22(21-15)10-11-2-1-3-13(18)8-11/h1-8,19H,9-10H2,(H,20,21,23)InChIKey
HPCCMMWEARKXCR-UHFFFAOYSA-NSynonyms
1282122-80-81282122808
3(((4bromophenyl)amino)methyl)1(3fluorobenzyl)1H124triazol5ol
5((4bromoanilino)methyl)2((3fluorophenyl)methyl)1H124triazol3one
C1=CC(=CC(=C1)F)CN2C(=O)N=C(N2)CNC3=CC=C(C=C3)Br
InChI=1SC16H14BrFN4Oc17124614(7512)199152016(23)22(2115)101121313(18)811h1819H910H2(H202123)
MFCD20757881
ZINC000061718861
ZINC61718861
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