Vitas-M small molecule compound
5-amino-1-(4-bromo-2-fluorobenzyl)-N-(2-chloro-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL094569
SMILES Cc1ccc(c(c1)Cl)NC(=O)c1nnn(c1N)Cc1ccc(cc1F)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 C17H14BrClFN5O MW 438.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrClFN5O/c1-9-2-5-14(12(19)6-9)22-17(26)15-16(21)25(24-23-15)8-10-3-4-11(18)7-13(10)20/h2-7H,8,21H2,1H3,(H,22,26)InChIKey
BYEGIYDRFHSWAN-UHFFFAOYSA-NSynonyms
5amino1((4bromo2fluorophenyl)methyl)N(2chloro4methylphenyl)triazole4carboxamide
5amino1(4bromo2fluorobenzyl)N(2chloro4methylphenyl)1H123triazole4carboxamide
CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=C(C=C(C=C3)Br)F)N)Cl
InChI=1SC17H14BrClFN5Oc192514(12(19)69)2217(26)1516(21)25(242315)8103411(18)713(10)20h27H821H21H3(H2226)
MFCD14726427
ZINC000009938846
ZINC9938846
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