Vitas-M small molecule compound
(5Z)-1-benzyl-5-{4-[2-(2-chlorophenoxy)ethoxy]-3,5-dimethoxybenzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK069636
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)Cc2ccccc2)cc(c1OCCOc1ccccc1Cl)OC
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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 C28H25ClN2O7 MW 536.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClN2O7/c1-35-23-15-19(16-24(36-2)25(23)38-13-12-37-22-11-7-6-10-21(22)29)14-20-26(32)30-28(34)31(27(20)33)17-18-8-4-3-5-9-18/h3-11,14-16H,12-13,17H2,1-2H3,(H,30,32,34)/b20-14-InChIKey
PVQKPSZQMOCPND-ZHZULCJRSA-NSynonyms
(5Z)1BENZYL5((4(2(2CHLOROPHENOXY)ETHOXY)35DIMETHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1BENZYL5(4(2(2CHLOROPHENOXY)ETHOXY)35DIMETHOXYBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=CC(=CC(=C1OCCOC2=CC=CC=C2Cl)OC)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CC=C4
COc1cc(C=C2C(=O)NC(=O)N(C2=O)Cc2ccccc2)cc(c1OCCOc1ccccc1Cl)OC
InChI=1SC28H25ClN2O7c135231519(1624(362)25(23)381312372211761021(22)29)142026(32)3028(34)31(27(20)33)17188435918h3111416H121317H212H3(H303234)b2014
MFCD05976245
STK069636
ZINC000097958911
ZINC97958911
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