Vitas-M small molecule compound
(5Z)-1-(4-bromophenyl)-5-[3-methoxy-4-(2-phenoxyethoxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK026507
SMILES COc1cc(ccc1OCCOc1ccccc1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)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 C26H21BrN2O6 MW 537.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21BrN2O6/c1-33-23-16-17(7-12-22(23)35-14-13-34-20-5-3-2-4-6-20)15-21-24(30)28-26(32)29(25(21)31)19-10-8-18(27)9-11-19/h2-12,15-16H,13-14H2,1H3,(H,28,30,32)/b21-15-InChIKey
BXXPNMOEUGQGOC-QNGOZBTKSA-NSynonyms
(5Z)1(4bromophenyl)5((3methoxy4(2phenoxyethoxy)phenyl)methylidene)13diazinane246trione
(5Z)1(4BROMOPHENYL)5(3METHOXY4(2PHENOXYETHOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)OCCOC4=CC=CC=C4
COc1cc(ccc1OCCOc1ccccc1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC26H21BrN2O6c133231617(71222(23)35141334205324620)152124(30)2826(32)29(25(21)31)1910818(27)91119h2121516H1314H21H3(H283032)b2115
MFCD05976082
STK026507
ZINC000097958102
ZINC97958102
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