Vitas-M small molecule compound
4-[(E)-{2-[(4-tert-butylphenoxy)acetyl]hydrazinylidene}methyl]-2-ethoxyphenyl 4-fluorobenzoate
Catalog ID
STK399066
SMILES CCOc1cc(/C=N/NC(=O)COc2ccc(cc2)C(C)(C)C)ccc1OC(=O)c1ccc(cc1)F
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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 C28H29FN2O5 MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29FN2O5/c1-5-34-25-16-19(6-15-24(25)36-27(33)20-7-11-22(29)12-8-20)17-30-31-26(32)18-35-23-13-9-21(10-14-23)28(2,3)4/h6-17H,5,18H2,1-4H3,(H,31,32)/b30-17+InChIKey
FKDDLJKUGYTEBJ-OCSSWDANSA-NSynonyms
(4((E)((2(4tertbutylphenoxy)acetyl)hydrazinylidene)methyl)2ethoxyphenyl)4fluorobenzoate
4((E)(2((4tertbutylphenoxy)acetyl)hydrazinylidene)methyl)2ethoxyphenyl4fluorobenzoate
CCOC1=C(C=CC(=C1)C=NNC(=O)COC2=CC=C(C=C2)C(C)(C)C)OC(=O)C3=CC=C(C=C3)F
CCOc1cc(C=NNC(=O)COc2ccc(cc2)C(C)(C)C)ccc1OC(=O)c1ccc(cc1)F
InChI=1SC28H29FN2O5c1534251619(61524(25)3627(33)2071122(29)12820)17303126(32)18352313921(101423)28(23)4h617H518H214H3(H3132)b3017+
MFCD01148972
ZINC000030937348
ZINC97024157
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