Vitas-M small molecule compound

2,6-di-tert-butyl-4-{[2-(3,5-di-tert-butyl-4-hydroxybenzyl)-4,5-dimethoxyphenyl]imino}cyclohexa-2,5-dien-1-one

Catalog ID
STK681602
SMILES COc1cc(/N=C/2\C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)c(cc1OC)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)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 C37H51NO4 MW 573.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H51NO4/c1-34(2,3)25-16-22(17-26(32(25)39)35(4,5)6)15-23-18-30(41-13)31(42-14)21-29(23)38-24-19-27(36(7,8)9)33(40)28(20-24)37(10,11)12/h16-21,39H,15H2,1-14H3
InChIKey
ZYBUWRFKULWIBK-UHFFFAOYSA-N
Synonyms

26DITERTBUTYL4((2(35DITERTBUTYL4HYDROXYBENZYL)45DIMETHOXYPHENYL)IMINO)CYCLOHEXA25DIEN1ONE
26ditertbutyl4((2(35ditertbutyl4hydroxybenzyl)45dimethoxyphenyl)imino)cyclohexa25dienone
26DITERTBUTYL4(2((35DITERTBUTYL4HYDROXYPHENYL)METHYL)45DIMETHOXYPHENYL)IMINOCYCLOHEXA25DIEN1ONE
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=CC(=C(C=C2N=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)OC)OC
COc1cc(N=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)c(cc1OC)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
InChI=1SC37H51NO4c134(23)251622(1726(32(25)39)35(45)6)15231830(4113)31(4214)2129(23)38241927(36(78)9)33(40)28(2024)37(1011)12h162139H15H2114H3
MFCD01878257
ZINC000098000166
ZINC98000166

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Available files

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