Vitas-M small molecule compound
(5E)-1-(3,5-dichlorophenyl)-5-(3,4-dimethoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL368148
SMILES COc1ccc(cc1OC)/C=C/1\C(=O)NC(=S)N(C1=O)c1cc(Cl)cc(c1)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 C19H14Cl2N2O4S MW 437.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Cl2N2O4S/c1-26-15-4-3-10(6-16(15)27-2)5-14-17(24)22-19(28)23(18(14)25)13-8-11(20)7-12(21)9-13/h3-9H,1-2H3,(H,22,24,28)/b14-5+InChIKey
VOSHGAJFOXEHIZ-LHHJGKSTSA-NSynonyms
(5E)1(35dichlorophenyl)5((34dimethoxyphenyl)methylidene)2sulfanylidene13diazinane46dione
(5E)1(35dichlorophenyl)5(34dimethoxybenzylidene)2thioxodihydropyrimidine46(1H5H)dione
COC1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC(=C3)Cl)Cl)OC
COc1ccc(cc1OC)C=C1C(=O)NC(=S)N(C1=O)c1cc(Cl)cc(c1)Cl
InChI=1SC19H14Cl2N2O4Sc126154310(616(15)272)51417(24)2219(28)23(18(14)25)13811(20)712(21)913h39H12H3(H222428)b145+
MFCD02290435
ZINC000096247946
ZINC96247946
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