Vitas-M small molecule compound
[1-(4-bromo-3-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Catalog ID
STK986389
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)c1nnn(c1C)c1ccc(c(c1)C)Br
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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 C21H21BrClN5O MW 474.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrClN5O/c1-14-12-18(6-7-19(14)22)28-15(2)20(24-25-28)21(29)27-10-8-26(9-11-27)17-5-3-4-16(23)13-17/h3-7,12-13H,8-11H2,1-2H3InChIKey
ZFIMAESDQKOZPW-UHFFFAOYSA-NSynonyms
(1(4bromo3methylphenyl)5methyl1H123triazol4yl)(4(3chlorophenyl)piperazin1yl)methanone
(1(4bromo3methylphenyl)5methyltriazol4yl)(4(3chlorophenyl)piperazin1yl)methanone
CC1=C(C=CC(=C1)N2C(=C(N=N2)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C)Br
InChI=1SC21H21BrClN5Oc1141218(6719(14)22)2815(2)20(242528)21(29)2710826(91127)1753416(23)1317h371213H811H212H3
MFCD18183290
ZINC000051317442
ZINC51317442
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