Vitas-M small molecule compound
1-{2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}-N-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129892
SMILES COc1ccc(cc1)NC(=O)c1nnn(c1C)CC(=O)Nc1ccc(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 C19H17BrFN5O3 MW 462.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrFN5O3/c1-11-18(19(28)22-13-4-6-14(29-2)7-5-13)24-25-26(11)10-17(27)23-16-8-3-12(20)9-15(16)21/h3-9H,10H2,1-2H3,(H,22,28)(H,23,27)InChIKey
LENRMMZGPYSRQU-UHFFFAOYSA-NSynonyms
1(2((4bromo2fluorophenyl)amino)2oxoethyl)N(4methoxyphenyl)5methyl1H123triazole4carboxamide
1(2(4bromo2fluoroanilino)2oxoethyl)N(4methoxyphenyl)5methyltriazole4carboxamide
CC1=C(N=NN1CC(=O)NC2=C(C=C(C=C2)Br)F)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC19H17BrFN5O3c11118(19(28)22134614(292)7513)242526(11)1017(27)23168312(20)915(16)21h39H10H212H3(H2228)(H2327)
MFCD20748038
ZINC000067323227
ZINC67323227
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