Vitas-M small molecule compound
(5E)-5-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-1-(3,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170380
SMILES C#CCOc1cc(Br)c(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)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 C23H19BrN2O5 MW 483.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O5/c1-5-8-31-20-12-18(24)15(11-19(20)30-4)10-17-21(27)25-23(29)26(22(17)28)16-7-6-13(2)14(3)9-16/h1,6-7,9-12H,8H2,2-4H3,(H,25,27,29)/b17-10+InChIKey
UWVTVFOFGDBBEF-LICLKQGHSA-NSynonyms
(5E)5((2BROMO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)1(34DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5(2BROMO5METHOXY4(PROP2YN1YLOXY)BENZYLIDENE)1(34DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
C#CCOc1cc(Br)c(cc1OC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)C
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3Br)OCC#C)OC)C(=O)NC2=O)C
InChI=1SC23H19BrN2O5c15831201218(24)15(1119(20)304)101721(27)2523(29)26(22(17)28)167613(2)14(3)916h167912H8H224H3(H252729)b1710+
MFCD02628741
ZINC000002972252
ZINC02972252
ZINC2972252
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