Vitas-M small molecule compound
(5E)-5-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-1-cyclohexylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK213549
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/1\C(=O)NC(=O)N(C1=O)C1CCCCC1
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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 C25H25ClN2O5 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O5/c1-32-22-14-17(9-12-21(22)33-15-16-7-10-18(26)11-8-16)13-20-23(29)27-25(31)28(24(20)30)19-5-3-2-4-6-19/h7-14,19H,2-6,15H2,1H3,(H,27,29,31)/b20-13+InChIKey
FLOKXUKDTCBLNH-DEDYPNTBSA-NSynonyms
(5E)5((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)1CYCLOHEXYL13DIAZINANE246TRIONE
(5E)5(4((4CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)1CYCLOHEXYLPYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)OCC4=CC=C(C=C4)Cl
COc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)NC(=O)N(C1=O)C1CCCCC1
InChI=1SC25H25ClN2O5c132221417(91221(22)33151671018(26)11816)132023(29)2725(31)28(24(20)30)195324619h71419H2615H21H3(H272931)b2013+
MFCD05821698
ZINC000012868180
ZINC12868180
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