Vitas-M small molecule compound

(5Z)-5-{3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK017861
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)OC)cc(c1OCCOc1ccc(c(c1)C)C)Br

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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 C30H29BrN2O7 MW 609.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29BrN2O7/c1-5-38-26-17-20(16-25(31)27(26)40-13-12-39-23-9-6-18(2)19(3)14-23)15-24-28(34)32-30(36)33(29(24)35)21-7-10-22(37-4)11-8-21/h6-11,14-17H,5,12-13H2,1-4H3,(H,32,34,36)/b24-15-
InChIKey
XUTZFCGUOMIBHZ-IWIPYMOSSA-N
Synonyms

(5Z)5((3bromo4(2(34dimethylphenoxy)ethoxy)5ethoxyphenyl)methylidene)1(4methoxyphenyl)13diazinane246trione
(5Z)5(3BROMO4(2(34DIMETHYLPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC)Br)OCCOC4=CC(=C(C=C4)C)C
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)OC)cc(c1OCCOc1ccc(c(c1)C)C)Br
InChI=1SC30H29BrN2O7c1538261720(1625(31)27(26)40131239239618(2)19(3)1423)152428(34)3230(36)33(29(24)35)2171022(374)11821h6111417H51213H214H3(H323436)b2415
MFCD02017675
STK017861
ZINC000100230322
ZINC100230322

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Available files

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