Vitas-M small molecule compound
1-(4-bromo-3-methylphenyl)-N-(butan-2-yl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK986637
SMILES CCC(NC(=O)c1nnn(c1C)c1ccc(c(c1)C)Br)C
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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 C15H19BrN4O MW 351.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19BrN4O/c1-5-10(3)17-15(21)14-11(4)20(19-18-14)12-6-7-13(16)9(2)8-12/h6-8,10H,5H2,1-4H3,(H,17,21)InChIKey
QYCYOKMXZHCBQA-UHFFFAOYSA-NSynonyms
1(4bromo3methylphenyl)N(butan2yl)5methyl1H123triazole4carboxamide
1(4bromo3methylphenyl)Nbutan2yl5methyltriazole4carboxamide
CCC(C)NC(=O)C1=C(N(N=N1)C2=CC(=C(C=C2)Br)C)C
InChI=1SC15H19BrN4Oc1510(3)1715(21)1411(4)20(191814)126713(16)9(2)812h6810H5H214H3(H1721)
MFCD18183532
ZINC000051317859
ZINC000051317861
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