Vitas-M small molecule compound
1-{2-[(4-bromo-2-fluorophenyl)amino]-2-oxoethyl}-N-(3-fluoro-4-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129896
SMILES Brc1ccc(c(c1)F)NC(=O)Cn1nnc(c1C)C(=O)Nc1ccc(c(c1)F)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 C19H16BrF2N5O2 MW 464.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrF2N5O2/c1-10-3-5-13(8-14(10)21)23-19(29)18-11(2)27(26-25-18)9-17(28)24-16-6-4-12(20)7-15(16)22/h3-8H,9H2,1-2H3,(H,23,29)(H,24,28)InChIKey
LEVKETMZNCXVRU-UHFFFAOYSA-NSynonyms
1(2((4bromo2fluorophenyl)amino)2oxoethyl)N(3fluoro4methylphenyl)5methyl1H123triazole4carboxamide
1(2(4bromo2fluoroanilino)2oxoethyl)N(3fluoro4methylphenyl)5methyltriazole4carboxamide
CC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=C(C=C(C=C3)Br)F)C)F
InChI=1SC19H16BrF2N5O2c1103513(814(10)21)2319(29)1811(2)27(262518)917(28)24166412(20)715(16)22h38H9H212H3(H2329)(H2428)
MFCD20748042
ZINC000067323238
ZINC67323238
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