Vitas-M small molecule compound

(5E)-5-(3-bromo-4-methoxybenzylidene)-1-(2,3-dichlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL374346
SMILES COc1ccc(cc1Br)/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 C18H11BrCl2N2O3S MW 486.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11BrCl2N2O3S/c1-26-14-6-5-9(8-11(14)19)7-10-16(24)22-18(27)23(17(10)25)13-4-2-3-12(20)15(13)21/h2-8H,1H3,(H,22,24,27)/b10-7+
InChIKey
LYQJKVHKVQOEGD-JXMROGBWSA-N
Synonyms

(5E)5((3BROMO4METHOXYPHENYL)METHYLIDENE)1(23DICHLOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(3bromo4methoxybenzylidene)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)Br
COc1ccc(cc1Br)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl
InChI=1SC18H11BrCl2N2O3Sc12614659(811(14)19)71016(24)2218(27)23(17(10)25)1342312(20)15(13)21h28H1H3(H222427)b107+
MFCD02305589
ZINC000001185944
ZINC01185944
ZINC1185944

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Available files

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