Vitas-M small molecule compound
(5Z)-5-[3,5-dichloro-4-(prop-2-yn-1-yloxy)benzylidene]-1-(4-hydroxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484714
SMILES C#CCOc1c(Cl)cc(cc1Cl)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
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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 C20H12Cl2N2O5 MW 431.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12Cl2N2O5/c1-2-7-29-17-15(21)9-11(10-16(17)22)8-14-18(26)23-20(28)24(19(14)27)12-3-5-13(25)6-4-12/h1,3-6,8-10,25H,7H2,(H,23,26,28)/b14-8-InChIKey
HZZMLBWNUZWTFV-ZSOIEALJSA-NSynonyms
(5Z)5((35dichloro4prop2ynoxyphenyl)methylidene)1(4hydroxyphenyl)13diazinane246trione
(5Z)5(35dichloro4(prop2yn1yloxy)benzylidene)1(4hydroxyphenyl)pyrimidine246(1H3H5H)trione
C#CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)O)Cl
C#CCOc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
InChI=1SC20H12Cl2N2O5c127291715(21)911(1016(17)22)81418(26)2320(28)24(19(14)27)123513(25)6412h13681025H7H2(H232628)b148
MFCD30713664
ZINC000002818468
ZINC2818468
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