Vitas-M small molecule compound
5-(4-{2-[2-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK088416
SMILES COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCCOc1ccccc1C(CC)C)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 C24H25ClN2O5S MW 488.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25ClN2O5S/c1-4-14(2)16-7-5-6-8-19(16)31-9-10-32-21-18(25)12-15(13-20(21)30-3)11-17-22(28)26-24(33)27-23(17)29/h5-8,11-14H,4,9-10H2,1-3H3,(H2,26,27,28,29,33)InChIKey
FRHUXRHJEZJJMY-UHFFFAOYSA-NSynonyms
5((4(2(2BUTAN2YLPHENOXY)ETHOXY)3CHLORO5METHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(4(2(2(BUTAN2YL)PHENOXY)ETHOXY)3CHLORO5METHOXYBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCC(C)C1=CC=CC=C1OCCOC2=C(C=C(C=C2Cl)C=C3C(=O)NC(=S)NC3=O)OC
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCCOc1ccccc1C(CC)C)Cl
InChI=1SC24H25ClN2O5Sc1414(2)16756819(16)31910322118(25)1215(1320(21)303)111722(28)2624(33)2723(17)29h581114H4910H213H3(H22627282933)
MFCD05975433
STK088416
ZINC000013894263
ZINC000013894266
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