Vitas-M small molecule compound
(5Z)-1-[4-(benzyloxy)phenyl]-5-[4-(prop-2-yn-1-yloxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484537
SMILES C#CCOc1ccc(cc1)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCc1ccccc1
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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 C27H20N2O5 MW 452.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N2O5/c1-2-16-33-22-12-8-19(9-13-22)17-24-25(30)28-27(32)29(26(24)31)21-10-14-23(15-11-21)34-18-20-6-4-3-5-7-20/h1,3-15,17H,16,18H2,(H,28,30,32)/b24-17-InChIKey
SQAIFQYGQRLNDY-ULJHMMPZSA-NSynonyms
(5Z)1(4(benzyloxy)phenyl)5(4(prop2yn1yloxy)benzylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4phenylmethoxyphenyl)5((4prop2ynoxyphenyl)methylidene)13diazinane246trione
C#CCOC1=CC=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OCC4=CC=CC=C4
C#CCOc1ccc(cc1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)OCc1ccccc1
InChI=1SC27H20N2O5c1216332212819(91322)172425(30)2827(32)29(26(24)31)21101423(151121)3418206435720h131517H1618H2(H283032)b2417
MFCD30713601
ZINC000012378678
ZINC12378678
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