Vitas-M small molecule compound
4-[(E)-{2-[(3,5-dimethylphenoxy)acetyl]hydrazinylidene}methyl]-2-ethoxyphenyl 4-methylbenzoate
Catalog ID
STK346536
SMILES CCOc1cc(/C=N/NC(=O)COc2cc(C)cc(c2)C)ccc1OC(=O)c1ccc(cc1)C
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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 C27H28N2O5 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5/c1-5-32-25-15-21(8-11-24(25)34-27(31)22-9-6-18(2)7-10-22)16-28-29-26(30)17-33-23-13-19(3)12-20(4)14-23/h6-16H,5,17H2,1-4H3,(H,29,30)/b28-16+InChIKey
PIFSXEYCXIEFCS-LQKURTRISA-NSynonyms
(4((E)((2(35dimethylphenoxy)acetyl)hydrazinylidene)methyl)2ethoxyphenyl)4methylbenzoate
4((E)(2((35dimethylphenoxy)acetyl)hydrazinylidene)methyl)2ethoxyphenyl4methylbenzoate
CCOC1=C(C=CC(=C1)C=NNC(=O)COC2=CC(=CC(=C2)C)C)OC(=O)C3=CC=C(C=C3)C
CCOc1cc(C=NNC(=O)COc2cc(C)cc(c2)C)ccc1OC(=O)c1ccc(cc1)C
InChI=1SC27H28N2O5c1532251521(81124(25)3427(31)229618(2)71022)16282926(30)1733231319(3)1220(4)1423h616H517H214H3(H2930)b2816+
MFCD01149183
ZINC000012859628
ZINC59475769
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