Vitas-M small molecule compound
(5E)-5-(2-bromo-4,5-dimethoxybenzylidene)-1-(4-chlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL374166
SMILES COc1cc(Br)c(cc1OC)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)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 C19H14BrClN2O4S MW 481.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrClN2O4S/c1-26-15-8-10(14(20)9-16(15)27-2)7-13-17(24)22-19(28)23(18(13)25)12-5-3-11(21)4-6-12/h3-9H,1-2H3,(H,22,24,28)/b13-7+InChIKey
IOEDDJLAOIXGKJ-NTUHNPAUSA-NSynonyms
(5E)5((2BROMO45DIMETHOXYPHENYL)METHYLIDENE)1(4CHLOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(2bromo45dimethoxybenzylidene)1(4chlorophenyl)2thioxodihydropyrimidine46(1H5H)dione
5((2BROMO45DIMETHOXYPHENYL)METHYLENE)1(4CHLOROPHENYL)2THIOXO13DIHYDROPYRIMIDINE46DIONE
COC1=C(C=C(C(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl)Br)OC
COc1cc(Br)c(cc1OC)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl
InChI=1SC19H14BrClN2O4Sc12615810(14(20)916(15)272)71317(24)2219(28)23(18(13)25)125311(21)4612h39H12H3(H222428)b137+
MFCD01470732
ZINC000001196593
ZINC01196593
ZINC1196593
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