Vitas-M small molecule compound
{4-[(E)-{2-[(1,3-benzodioxol-5-ylamino)acetyl]hydrazinylidene}methyl]-2-chloro-6-methoxyphenoxy}acetic acid (non-preferred name)
Catalog ID
STL370030
SMILES COc1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc(c1OCC(=O)O)Cl
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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 C19H18ClN3O7 MW 435.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O7/c1-27-16-5-11(4-13(20)19(16)28-9-18(25)26)7-22-23-17(24)8-21-12-2-3-14-15(6-12)30-10-29-14/h2-7,21H,8-10H2,1H3,(H,23,24)(H,25,26)/b22-7+InChIKey
JWNXEYMMNBTOTE-QPJQQBGISA-NSynonyms
(4((E)(2((13benzodioxol5ylamino)acetyl)hydrazinylidene)methyl)2chloro6methoxyphenoxy)aceticacid(nonpreferredname)
2(4((E)((2(13benzodioxol5ylamino)acetyl)hydrazinylidene)methyl)2chloro6methoxyphenoxy)aceticacid
COC1=C(C(=CC(=C1)C=NNC(=O)CNC2=CC3=C(C=C2)OCO3)Cl)OCC(=O)O
COc1cc(C=NNC(=O)CNc2ccc3c(c2)OCO3)cc(c1OCC(=O)O)Cl
InChI=1SC19H18ClN3O7c12716511(413(20)19(16)28918(25)26)7222317(24)82112231415(612)30102914h2721H810H21H3(H2324)(H2526)b227+
MFCD17010764
ZINC000038534816
ZINC96836096
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