Vitas-M small molecule compound
(5E)-1-(4-bromo-3-methylphenyl)-5-[3-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170327
SMILES C#CCOc1ccc(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)Br
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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 C22H17BrN2O5 MW 469.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN2O5/c1-4-9-30-18-8-5-14(12-19(18)29-3)11-16-20(26)24-22(28)25(21(16)27)15-6-7-17(23)13(2)10-15/h1,5-8,10-12H,9H2,2-3H3,(H,24,26,28)/b16-11+InChIKey
LDVNOWWHTJYEMX-LFIBNONCSA-NSynonyms
(5E)1(4BROMO3METHYLPHENYL)5((3METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(4BROMO3METHYLPHENYL)5(3METHOXY4(PROP2YN1YLOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
1(4BROMO3METHYLPHENYL)5(3METHOXY4(2PROPYNYLOXY)BENZYLIDENE)246(1H3H5H)PYRIMIDINETRIONE
C#CCOc1ccc(cc1OC)C=C1C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)Br
CC1=C(C=CC(=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC#C)OC)C(=O)NC2=O)Br
InChI=1SC22H17BrN2O5c14930188514(1219(18)293)111620(26)2422(28)25(21(16)27)156717(23)13(2)1015h1581012H9H223H3(H242628)b1611+
MFCD02379424
ZINC000002193086
ZINC02193086
ZINC2193086
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