Vitas-M small molecule compound
N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]-2-[3-cyano-4-(methoxymethyl)-6-methyl-2-oxopyridin-1(2H)-yl]acetohydrazide
Catalog ID
STL378430
SMILES COCc1cc(C)n(c(=O)c1C#N)CC(=O)N/N=C/c1ccc(c(c1)OC)Oc1nc(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 C23H20ClFN6O5 MW 514.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClFN6O5/c1-13-6-15(12-34-2)16(8-26)22(33)31(13)11-20(32)30-28-9-14-4-5-18(19(7-14)35-3)36-21-17(25)10-27-23(24)29-21/h4-7,9-10H,11-12H2,1-3H3,(H,30,32)/b28-9+InChIKey
PPHGGDAWIMQQPC-HIUVJMHLSA-NSynonyms
CC1=CC(=C(C(=O)N1CC(=O)NN=CC2=CC(=C(C=C2)OC3=NC(=NC=C3F)Cl)OC)C#N)COC
COCc1cc(C)n(c(=O)c1C#N)CC(=O)NN=Cc1ccc(c(c1)OC)Oc1nc(Cl)ncc1F
InChI=1SC23H20ClFN6O5c113615(12342)16(826)22(33)31(13)1120(32)30289144518(19(714)353)362117(25)102723(24)2921h47910H1112H213H3(H3032)b289+
MFCD05040400
N((E)(4((2chloro5fluoropyrimidin4yl)oxy)3methoxyphenyl)methylidene)2(3cyano4(methoxymethyl)6methyl2oxopyridin1(2H)yl)acetohydrazide
N((E)(4(2chloro5fluoropyrimidin4yl)oxy3methoxyphenyl)methylideneamino)2(3cyano4(methoxymethyl)6methyl2oxopyridin1yl)acetamide
ZINC000015018618
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