Vitas-M small molecule compound
(5Z)-1-[4-(butan-2-yl)phenyl]-5-{4-[(4-fluorobenzyl)oxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK059878
SMILES CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(cc2)OCc2ccc(cc2)F)/C1=O)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 C28H25FN2O4 MW 472.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25FN2O4/c1-3-18(2)21-8-12-23(13-9-21)31-27(33)25(26(32)30-28(31)34)16-19-6-14-24(15-7-19)35-17-20-4-10-22(29)11-5-20/h4-16,18H,3,17H2,1-2H3,(H,30,32,34)/b25-16-InChIKey
BSNNZAOIDSEZIT-XYGWBWBKSA-NSynonyms
(5Z)1(4(BUTAN2YL)PHENYL)5(4((4FLUOROBENZYL)OXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)1(4BUTAN2YLPHENYL)5((4((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)13DIAZINANE246TRIONE
CCC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=C(C=C4)F)C(=O)NC2=O
CCC(c1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(cc2)OCc2ccc(cc2)F)C1=O)C
InChI=1SC28H25FN2O4c1318(2)2181223(13921)3127(33)25(26(32)3028(31)34)161961424(15719)35172041022(29)11520h41618H317H212H3(H303234)b2516
MFCD05975155
STK059878
ZINC000009553451
ZINC000013896604
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