Vitas-M small molecule compound
(5Z)-1-(2,4-dichlorophenyl)-5-[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170479
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2Cl)Cl)cc(c1O)CC=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 C22H18Cl2N2O5 MW 461.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl2N2O5/c1-3-5-13-8-12(10-18(19(13)27)31-4-2)9-15-20(28)25-22(30)26(21(15)29)17-7-6-14(23)11-16(17)24/h3,6-11,27H,1,4-5H2,2H3,(H,25,28,30)/b15-9-InChIKey
KNUSMYZJNDLIJU-DHDCSXOGSA-NSynonyms
(5Z)1(24DICHLOROPHENYL)5((3ETHOXY4HYDROXY5PROP2ENYLPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(24DICHLOROPHENYL)5(3ETHOXY4HYDROXY5(PROP2EN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=C(C=C(C=C3)Cl)Cl
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2Cl)Cl)cc(c1O)CC=C
InChI=1SC22H18Cl2N2O5c13513812(1018(19(13)27)3142)91520(28)2522(30)26(21(15)29)177614(23)1116(17)24h361127H145H22H3(H252830)b159
MFCD04585110
ZINC000001169907
ZINC01169907
ZINC1169907
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