Vitas-M small molecule compound
2-hydroxy-N'-[(E)-{3-iodo-5-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}methylidene]benzohydrazide
Catalog ID
STL387689
SMILES COc1cc(/C=N/NC(=O)c2ccccc2O)cc(c1OCc1ccc(cc1)[N+](=O)[O-])I
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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 C22H18IN3O6 MW 547.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18IN3O6/c1-31-20-11-15(12-24-25-22(28)17-4-2-3-5-19(17)27)10-18(23)21(20)32-13-14-6-8-16(9-7-14)26(29)30/h2-12,27H,13H2,1H3,(H,25,28)/b24-12+InChIKey
HQMRRCQQNBOJFL-WYMPLXKRSA-NSynonyms
2hydroxyN((E)(3iodo5methoxy4((4nitrobenzyl)oxy)phenyl)methylidene)benzohydrazide
2hydroxyN((E)(3iodo5methoxy4((4nitrophenyl)methoxy)phenyl)methylideneamino)benzamide
COC1=C(C(=CC(=C1)C=NNC(=O)C2=CC=CC=C2O)I)OCC3=CC=C(C=C3)(N+)(=O)(O)
COc1cc(C=NNC(=O)c2ccccc2O)cc(c1OCc1ccc(cc1)(N+)(=O)(O))I
InChI=1SC22H18IN3O6c131201115(12242522(28)17423519(17)27)1018(23)21(20)3213146816(9714)26(29)30h21227H13H21H3(H2528)b2412+
MFCD17010776
ZINC000101023230
ZINC100956157
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