Vitas-M small molecule compound

5-[4-(benzyloxy)-3-ethoxy-5-iodobenzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL388295
SMILES CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCc1ccccc1)I

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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 C20H17IN2O4S MW 508.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17IN2O4S/c1-2-26-16-10-13(8-14-18(24)22-20(28)23-19(14)25)9-15(21)17(16)27-11-12-6-4-3-5-7-12/h3-10H,2,11H2,1H3,(H2,22,23,24,25,28)
InChIKey
HMMAMZIALHUNOS-UHFFFAOYSA-N
Synonyms

5((3ETHOXY5IODO4PHENYLMETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(4(benzyloxy)3ethoxy5iodobenzylidene)2thioxodihydropyrimidine46(1H5H)dione
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)NC2=O)I)OCC3=CC=CC=C3
InChI=1SC20H17IN2O4Sc1226161013(81418(24)2220(28)2319(14)25)915(21)17(16)2711126435712h310H211H21H3(H22223242528)
MFCD02209065
ZINC000002916131
ZINC02916131
ZINC2916131

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Available files

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