Vitas-M small molecule compound
ethyl 1-{[(Z)-(4-fluorophenyl)methylidene]amino}-5-[2-(4-methoxyphenyl)-2-oxoethoxy]-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STL437135
SMILES CCOC(=O)c1nnn(c1OCC(=O)c1ccc(cc1)OC)/N=C\c1ccc(cc1)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 C21H19FN4O5 MW 426.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O5/c1-3-30-21(28)19-20(31-13-18(27)15-6-10-17(29-2)11-7-15)26(25-24-19)23-12-14-4-8-16(22)9-5-14/h4-12H,3,13H2,1-2H3/b23-12-InChIKey
NYHFVMDKRFKQAV-FMCGGJTJSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)N=CC2=CC=C(C=C2)F)OCC(=O)C3=CC=C(C=C3)OC
CCOC(=O)c1nnn(c1OCC(=O)c1ccc(cc1)OC)N=Cc1ccc(cc1)F
ethyl1(((Z)(4fluorophenyl)methylidene)amino)5(2(4methoxyphenyl)2oxoethoxy)1H123triazole4carboxylate
ETHYL1((Z)(4FLUOROPHENYL)METHYLIDENEAMINO)5(2(4METHOXYPHENYL)2OXOETHOXY)TRIAZOLE4CARBOXYLATE
InChI=1SC21H19FN4O5c133021(28)1920(311318(27)1561017(292)11715)26(252419)2312144816(22)9514h412H313H212H3b2312
MFCD06242969
ZINC000033338115
ZINC1418385
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