Vitas-M small molecule compound
(4-{(E)-[1-(4-tert-butylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Catalog ID
STK621154
SMILES COc1cc(ccc1OCC(=O)O)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)C(C)(C)C)S
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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 C24H24N2O6S MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O6S/c1-24(2,3)15-6-8-16(9-7-15)26-22(30)17(21(29)25-23(26)33)11-14-5-10-18(19(12-14)31-4)32-13-20(27)28/h5-12H,13H2,1-4H3,(H,27,28)(H,25,29,33)/b17-11+InChIKey
MVPSIEZLMATENJ-GZTJUZNOSA-NSynonyms
(4((E)(1(4tertbutylphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)2methoxyphenoxy)aceticacid
2(4((E)(1(4TERTBUTYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETICACID
COc1cc(ccc1OCC(=O)O)C=C1C(=O)N=C(N(C1=O)c1ccc(cc1)C(C)(C)C)S
InChI=1SC24H24N2O6Sc124(23)156816(9715)2622(30)17(21(29)2523(26)33)111451018(19(1214)314)321320(27)28h512H13H214H3(H2728)(H252933)b1711+
MFCD09792079
ZINC000013801143
ZINC13801143
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