Vitas-M small molecule compound
(5Z)-5-{2-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK082522
SMILES CCc1cc(OCCOc2ccccc2/C=C\2/C(=O)NC(=O)N(C2=O)c2cccc(c2)C)cc(c1)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 C29H28N2O5 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O5/c1-4-21-14-20(3)16-24(17-21)35-12-13-36-26-11-6-5-9-22(26)18-25-27(32)30-29(34)31(28(25)33)23-10-7-8-19(2)15-23/h5-11,14-18H,4,12-13H2,1-3H3,(H,30,32,34)/b25-18-InChIKey
FQWUBEJGCBPIAQ-BWAHOGKJSA-NSynonyms
(5Z)5((2(2(3ethyl5methylphenoxy)ethoxy)phenyl)methylidene)1(3methylphenyl)13diazinane246trione
(5Z)5(2(2(3ETHYL5METHYLPHENOXY)ETHOXY)BENZYLIDENE)1(3METHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC(=CC(=C1)C)OCCOC2=CC=CC=C2C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC(=C4)C
CCc1cc(OCCOc2ccccc2C=C2C(=O)NC(=O)N(C2=O)c2cccc(c2)C)cc(c1)C
InChI=1SC29H28N2O5c14211420(3)1624(1721)35121336261165922(26)182527(32)3029(34)31(28(25)33)23107819(2)1523h5111418H41213H213H3(H303234)b2518
MFCD02017741
STK082522
ZINC000009678806
ZINC09678806
ZINC9678806
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