Vitas-M small molecule compound
N'-[(E)-{4-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-3-methoxyphenyl}methylidene]-2-(9-oxoacridin-10(9H)-yl)acetohydrazide
Catalog ID
STL384088
SMILES COc1cc(/C=N/NC(=O)Cn2c3ccccc3c(=O)c3c2cccc3)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 C27H19ClFN5O4 MW 531.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClFN5O4/c1-37-23-12-16(10-11-22(23)38-26-19(29)14-30-27(28)32-26)13-31-33-24(35)15-34-20-8-4-2-6-17(20)25(36)18-7-3-5-9-21(18)34/h2-14H,15H2,1H3,(H,33,35)/b31-13+InChIKey
ZYRTYTNLYMHRAL-IURWMYGYSA-NSynonyms
COC1=C(C=CC(=C1)C=NNC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42)OC5=NC(=NC=C5F)Cl
COc1cc(C=NNC(=O)Cn2c3ccccc3c(=O)c3c2cccc3)ccc1Oc1nc(Cl)ncc1F
InChI=1SC27H19ClFN5O4c137231216(101122(23)382619(29)143027(28)3226)13313324(35)153420842617(20)25(36)18735921(18)34h214H15H21H3(H3335)b3113+
MFCD05040600
N((E)(4((2chloro5fluoropyrimidin4yl)oxy)3methoxyphenyl)methylidene)2(9oxoacridin10(9H)yl)acetohydrazide
N((E)(4(2chloro5fluoropyrimidin4yl)oxy3methoxyphenyl)methylideneamino)2(9oxoacridin10yl)acetamide
ZINC000100304989
ZINC100310233
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