Vitas-M small molecule compound

5-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-methoxybenzylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK044048
SMILES COc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=C1C(=O)N(C)C(=O)N(C1=O)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 C26H30N2O6 MW 466.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O6/c1-26(2,3)18-8-10-19(11-9-18)33-13-14-34-21-12-7-17(16-22(21)32-6)15-20-23(29)27(4)25(31)28(5)24(20)30/h7-12,15-16H,13-14H2,1-6H3
InChIKey
INDSOFRZZHKFGX-UHFFFAOYSA-N
Synonyms

5((4(2(4TERTBUTYLPHENOXY)ETHOXY)3METHOXYPHENYL)METHYLIDENE)13DIMETHYL13DIAZINANE246TRIONE
5(4(2(4TERTBUTYLPHENOXY)ETHOXY)3METHOXYBENZYLIDENE)13DIMETHYLPYRIMIDINE246(1H3H5H)TRIONE
CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=C3C(=O)N(C(=O)N(C3=O)C)C)OC
COc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)C=C1C(=O)N(C)C(=O)N(C1=O)C
InChI=1SC26H30N2O6c126(23)1881019(11918)331314342112717(1622(21)326)152023(29)27(4)25(31)28(5)24(20)30h7121516H1314H216H3
MFCD02017607
STK044048
ZINC000009425657
ZINC09425657
ZINC9425657

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Available files

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