Vitas-M small molecule compound
N'-[(E)-{4-[(4-bromobenzyl)oxy]-3-iodo-5-methoxyphenyl}methylidene]-2-(2-methyl-1,3-dioxolan-2-yl)acetohydrazide
Catalog ID
STK044378
SMILES COc1cc(/C=N/NC(=O)CC2(C)OCCO2)cc(c1OCc1ccc(cc1)Br)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 C21H22BrIN2O5 MW 589.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrIN2O5/c1-21(29-7-8-30-21)11-19(26)25-24-12-15-9-17(23)20(18(10-15)27-2)28-13-14-3-5-16(22)6-4-14/h3-6,9-10,12H,7-8,11,13H2,1-2H3,(H,25,26)/b24-12+InChIKey
UQSQJQPAECBLBP-WYMPLXKRSA-NSynonyms
CC1(OCCO1)CC(=O)NN=CC2=CC(=C(C(=C2)I)OCC3=CC=C(C=C3)Br)OC
COc1cc(C=NNC(=O)CC2(C)OCCO2)cc(c1OCc1ccc(cc1)Br)I
InChI=1SC21H22BrIN2O5c121(29783021)1119(26)25241215917(23)20(18(1015)272)2813143516(22)6414h3691012H781113H212H3(H2526)b2412+
MFCD06166893
N((E)(4((4BROMOBENZYL)OXY)3IODO5METHOXYPHENYL)METHYLIDENE)2(2METHYL13DIOXOLAN2YL)ACETOHYDRAZIDE
N((E)(4((4bromophenyl)methoxy)3iodo5methoxyphenyl)methylideneamino)2(2methyl13dioxolan2yl)acetamide
STK044378
ZINC000097958594
ZINC101432138
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