Vitas-M small molecule compound

N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-ethoxyphenyl}methylidene]-4-methylbenzenesulfonohydrazide

Catalog ID
STK698730
SMILES CCOc1cc(/C=N/NS(=O)(=O)c2ccc(cc2)C)ccc1Oc1nc(Cl)ncc1F

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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 C20H18ClFN4O4S MW 464.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClFN4O4S/c1-3-29-18-10-14(6-9-17(18)30-19-16(22)12-23-20(21)25-19)11-24-26-31(27,28)15-7-4-13(2)5-8-15/h4-12,26H,3H2,1-2H3/b24-11+
InChIKey
FZMKIFAZKSHWMP-BHGWPJFGSA-N
Synonyms
384368-44-9
(E)N(4((2chloro5fluoropyrimidin4yl)oxy)3ethoxybenzylidene)4methylbenzenesulfonohydrazide
384368449
CCOC1=C(C=CC(=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)C)OC3=NC(=NC=C3F)Cl
CCOc1cc(C=NNS(=O)(=O)c2ccc(cc2)C)ccc1Oc1nc(Cl)ncc1F
InChI=1SC20H18ClFN4O4Sc1329181014(6917(18)301916(22)122320(21)2519)11242631(2728)157413(2)5815h41226H3H212H3b2411+
MFCD02629748
N((E)(4((2chloro5fluoropyrimidin4yl)oxy)3ethoxyphenyl)methylidene)4methylbenzenesulfonohydrazide
N((E)(4(2CHLORO5FLUOROPYRIMIDIN4YL)OXY3ETHOXYPHENYL)METHYLIDENEAMINO)4METHYLBENZENESULFONAMIDE
ZINC000002319216
ZINC33360419

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.