Vitas-M small molecule compound
2-methoxy-4-[(E)-(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl benzoate
Catalog ID
STK745738
SMILES COc1cc(/C=N/NC(=O)COc2ccc(cc2)C(CC(C)(C)C)(C)C)ccc1OC(=O)c1ccccc1
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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 C31H36N2O5 MW 516.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O5/c1-30(2,3)21-31(4,5)24-13-15-25(16-14-24)37-20-28(34)33-32-19-22-12-17-26(27(18-22)36-6)38-29(35)23-10-8-7-9-11-23/h7-19H,20-21H2,1-6H3,(H,33,34)/b32-19+InChIKey
RTUJIWLDSGYMKR-BIZUNTBRSA-NSynonyms
(2methoxy4((E)((2(4(244trimethylpentan2yl)phenoxy)acetyl)hydrazinylidene)methyl)phenyl)benzoate
2methoxy4((E)(2((4(244trimethylpentan2yl)phenoxy)acetyl)hydrazinylidene)methyl)phenylbenzoate
CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC
COc1cc(C=NNC(=O)COc2ccc(cc2)C(CC(C)(C)C)(C)C)ccc1OC(=O)c1ccccc1
InChI=1SC31H36N2O5c130(23)2131(45)24131525(161424)372028(34)33321922121726(27(1822)366)3829(35)23108791123h719H2021H216H3(H3334)b3219+
MFCD00313723
ZINC000006074281
ZINC33908368
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