Vitas-M small molecule compound
(5Z)-5-(3-chloro-4-hydroxybenzylidene)-1-(3-chloro-4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL484471
SMILES O=C1NC(=O)/C(=C/c2ccc(c(c2)Cl)O)/C(=O)N1c1ccc(c(c1)Cl)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 C18H12Cl2N2O4 MW 391.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2N2O4/c1-9-2-4-11(8-13(9)19)22-17(25)12(16(24)21-18(22)26)6-10-3-5-15(23)14(20)7-10/h2-8,23H,1H3,(H,21,24,26)/b12-6-InChIKey
VACFMHSDJXTPRC-SDQBBNPISA-NSynonyms
(5Z)5((3chloro4hydroxyphenyl)methylidene)1(3chloro4methylphenyl)13diazinane246trione
(5Z)5(3chloro4hydroxybenzylidene)1(3chloro4methylphenyl)pyrimidine246(1H3H5H)trione
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)O)Cl)C(=O)NC2=O)Cl
InChI=1SC18H12Cl2N2O4c192411(813(9)19)2217(25)12(16(24)2118(22)26)6103515(23)14(20)710h2823H1H3(H212426)b126
MFCD30713543
O=C1NC(=O)C(=Cc2ccc(c(c2)Cl)O)C(=O)N1c1ccc(c(c1)Cl)C
ZINC000034234840
ZINC34234840
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