Vitas-M small molecule compound
5-(2,3-dibromo-5-ethoxy-4-hydroxybenzylidene)-1,3-diphenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368217
SMILES CCOc1cc(/C=C/2\C(=O)N(c3ccccc3)C(=S)N(C2=O)c2ccccc2)c(c(c1O)Br)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 C25H18Br2N2O4S MW 602.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18Br2N2O4S/c1-2-33-19-14-15(20(26)21(27)22(19)30)13-18-23(31)28(16-9-5-3-6-10-16)25(34)29(24(18)32)17-11-7-4-8-12-17/h3-14,30H,2H2,1H3InChIKey
GLVWMTDFJICHRP-UHFFFAOYSA-NSynonyms
5((23dibromo5ethoxy4hydroxyphenyl)methylidene)13diphenyl2sulfanylidene13diazinane46dione
5(23dibromo5ethoxy4hydroxybenzylidene)13diphenyl2thioxodihydropyrimidine46(1H5H)dione
CCOC1=C(C(=C(C(=C1)C=C2C(=O)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)Br)Br)O
CCOc1cc(C=C2C(=O)N(c3ccccc3)C(=S)N(C2=O)c2ccccc2)c(c(c1O)Br)Br
InChI=1SC25H18Br2N2O4Sc1233191415(20(26)21(27)22(19)30)131823(31)28(1695361016)25(34)29(24(18)32)17117481217h31430H2H21H3
MFCD28952076
ZINC000101104196
ZINC101104196
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