Vitas-M small molecule compound

(5E)-5-({1-[2-(2,4-dimethylphenoxy)ethyl]-1H-pyrrol-2-yl}methylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK084653
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cccn2CCOc2ccc(cc2C)C)/C1=O

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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 C27H27N3O4 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O4/c1-4-20-8-10-21(11-9-20)30-26(32)23(25(31)28-27(30)33)17-22-6-5-13-29(22)14-15-34-24-12-7-18(2)16-19(24)3/h5-13,16-17H,4,14-15H2,1-3H3,(H,28,31,33)/b23-17+
InChIKey
YVFNMERKHSKWDX-HAVVHWLPSA-N
Synonyms
672944-89-7
(5E)5((1(2(24DIMETHYLPHENOXY)ETHYL)1HPYRROL2YL)METHYLIDENE)1(4ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5E)5((1(2(24DIMETHYLPHENOXY)ETHYL)1HPYRROL2YL)METHYLIDENE)3(4ETHYLPHENYL)6HYDROXYPYRIMIDINE24(3H5H)DIONE
(5E)5((1(2(24DIMETHYLPHENOXY)ETHYL)PYRROL2YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(E)5((1(2(24dimethylphenoxy)ethyl)1Hpyrrol2yl)methylene)1(4ethylphenyl)pyrimidine246(1H3H5H)trione
672944897
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CN3CCOC4=C(C=C(C=C4)C)C)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cccn2CCOc2ccc(cc2C)C)C1=O
InChI=1SC27H27N3O4c142081021(11920)3026(32)23(25(31)2827(30)33)1722651329(22)1415342412718(2)1619(24)3h5131617H41415H213H3(H283133)b2317+
MFCD04006077
STK084653
ZINC2263017

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Available files

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