Vitas-M small molecule compound

2-hydroxy-N'-{(1E)-1-[4-hydroxy-1-(4-methoxyphenyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}benzohydrazide

Catalog ID
STK584717
SMILES CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/NNC(=O)c1ccccc1O

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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 C21H20N4O6 MW 424.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O6/c1-3-15(23-24-18(27)14-6-4-5-7-16(14)26)17-19(28)22-21(30)25(20(17)29)12-8-10-13(31-2)11-9-12/h4-11,23,26H,3H2,1-2H3,(H,24,27)(H,22,28,30)/b17-15+
InChIKey
AAQNRRWCWSRBAC-BMRADRMJSA-N
Synonyms

2hydroxyN((1E)1(1(4methoxyphenyl)246trioxo13diazinan5ylidene)propyl)benzohydrazide
2hydroxyN((1E)1(4hydroxy1(4methoxyphenyl)26dioxo16dihydropyrimidin5(2H)ylidene)propyl)benzohydrazide
CCC(=C1C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)NNC(=O)c1ccccc1O
CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)OC)NNC(=O)C3=CC=CC=C3O
InChI=1SC21H20N4O6c1315(232418(27)14645716(14)26)1719(28)2221(30)25(20(17)29)1281013(312)11912h4112326H3H212H3(H2427)(H222830)b1715+
MFCD07211550
ZINC000013513065
ZINC13513065

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Available files

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