Vitas-M small molecule compound
1-(3-fluoro-4-methylphenyl)-5-methyl-N-(3-phenylpropyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STK986573
SMILES O=C(c1nnn(c1C)c1ccc(c(c1)F)C)NCCCc1ccccc1
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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 C20H21FN4O MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN4O/c1-14-10-11-17(13-18(14)21)25-15(2)19(23-24-25)20(26)22-12-6-9-16-7-4-3-5-8-16/h3-5,7-8,10-11,13H,6,9,12H2,1-2H3,(H,22,26)InChIKey
SQQUIPDHULODLM-UHFFFAOYSA-NSynonyms
1(3fluoro4methylphenyl)5methylN(3phenylpropyl)1H123triazole4carboxamide
1(3fluoro4methylphenyl)5methylN(3phenylpropyl)triazole4carboxamide
CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=O)NCCCC3=CC=CC=C3)C)F
InChI=1SC20H21FN4Oc114101117(1318(14)21)2515(2)19(232425)20(26)221269167435816h3578101113H6912H212H3(H2226)
MFCD18183470
ZINC000051317743
ZINC51317743
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