Vitas-M small molecule compound
ethyl 5-[2-(4-bromophenyl)-2-oxoethoxy]-1-{[(E)-(3-fluorophenyl)methylidene]amino}-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STL438261
SMILES CCOC(=O)c1nnn(c1OCC(=O)c1ccc(cc1)Br)/N=C/c1cccc(c1)F
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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 C20H16BrFN4O4 MW 475.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrFN4O4/c1-2-29-20(28)18-19(30-12-17(27)14-6-8-15(21)9-7-14)26(25-24-18)23-11-13-4-3-5-16(22)10-13/h3-11H,2,12H2,1H3/b23-11+InChIKey
AKIGJYIIAKNPDR-FOKLQQMPSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)N=CC2=CC(=CC=C2)F)OCC(=O)C3=CC=C(C=C3)Br
CCOC(=O)c1nnn(c1OCC(=O)c1ccc(cc1)Br)N=Cc1cccc(c1)F
ethyl5(2(4bromophenyl)2oxoethoxy)1(((E)(3fluorophenyl)methylidene)amino)1H123triazole4carboxylate
ethyl5(2(4bromophenyl)2oxoethoxy)1((E)(3fluorophenyl)methylideneamino)triazole4carboxylate
InChI=1SC20H16BrFN4O4c122920(28)1819(301217(27)146815(21)9714)26(252418)23111343516(22)1013h311H212H21H3b2311+
MFCD06242970
ZINC000001418389
ZINC33338117
Check stock
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