Vitas-M small molecule compound
ethyl 1-{[(Z)-(4-chlorophenyl)methylidene]amino}-5-(2-oxo-2-phenylethoxy)-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STL437133
SMILES CCOC(=O)c1nnn(c1OCC(=O)c1ccccc1)/N=C\c1ccc(cc1)Cl
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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 C20H17ClN4O4 MW 412.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O4/c1-2-28-20(27)18-19(29-13-17(26)15-6-4-3-5-7-15)25(24-23-18)22-12-14-8-10-16(21)11-9-14/h3-12H,2,13H2,1H3/b22-12-InChIKey
OGPFHXXLXRUWGX-UUYOSTAYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)N=CC2=CC=C(C=C2)Cl)OCC(=O)C3=CC=CC=C3
CCOC(=O)c1nnn(c1OCC(=O)c1ccccc1)N=Cc1ccc(cc1)Cl
ethyl1(((Z)(4chlorophenyl)methylidene)amino)5(2oxo2phenylethoxy)1H123triazole4carboxylate
ETHYL1((Z)(4CHLOROPHENYL)METHYLIDENEAMINO)5PHENACYLOXYTRIAZOLE4CARBOXYLATE
InChI=1SC20H17ClN4O4c122820(27)1819(291317(26)156435715)25(242318)22121481016(21)11914h312H213H21H3b2212
MFCD06242979
ZINC000033338126
ZINC1418409
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