Vitas-M small molecule compound
(5Z)-5-[3-bromo-4-(prop-2-en-1-yloxy)benzylidene]-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176598
SMILES C=CCOc1ccc(cc1Br)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)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 C21H17BrN2O4 MW 441.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O4/c1-3-9-28-18-8-7-14(12-17(18)22)11-16-19(25)23-21(27)24(20(16)26)15-6-4-5-13(2)10-15/h3-8,10-12H,1,9H2,2H3,(H,23,25,27)/b16-11-InChIKey
SMIODVSMKAWCIX-WJDWOHSUSA-NSynonyms
(5Z)5((3BROMO4PROP2ENOXYPHENYL)METHYLIDENE)1(3METHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5(3BROMO4(PROP2EN1YLOXY)BENZYLIDENE)1(3METHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
C=CCOc1ccc(cc1Br)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)C
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC=C)Br)C(=O)NC2=O
InChI=1SC21H17BrN2O4c13928188714(1217(18)22)111619(25)2321(27)24(20(16)26)1564513(2)1015h381012H19H22H3(H232527)b1611
MFCD02623674
ZINC000006886408
ZINC06886408
ZINC6886408
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