Vitas-M small molecule compound
(5E)-5-(2-chloro-4,5-dimethoxybenzylidene)-1-(2,3-dichlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL374337
SMILES COc1cc(Cl)c(cc1OC)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
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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 C19H13Cl3N2O4S MW 471.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl3N2O4S/c1-27-14-7-9(12(21)8-15(14)28-2)6-10-17(25)23-19(29)24(18(10)26)13-5-3-4-11(20)16(13)22/h3-8H,1-2H3,(H,23,25,29)/b10-6+InChIKey
VWBJVLLUFSQEPE-UXBLZVDNSA-NSynonyms
(5E)5((2CHLORO45DIMETHOXYPHENYL)METHYLIDENE)1(23DICHLOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(2chloro45dimethoxybenzylidene)1(23dichlorophenyl)2thioxodihydropyrimidine46(1H5H)dione
COC1=C(C=C(C(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C(=CC=C3)Cl)Cl)Cl)OC
COc1cc(Cl)c(cc1OC)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
InChI=1SC19H13Cl3N2O4Sc1271479(12(21)815(14)282)61017(25)2319(29)24(18(10)26)1353411(20)16(13)22h38H12H3(H232529)b106+
MFCD02637851
ZINC000001186210
ZINC01186210
ZINC1186210
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