Vitas-M small molecule compound
4-({4-[(1,3-diethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-2-methoxyphenoxy}methyl)benzoic acid
Catalog ID
STK190111
SMILES CCN1C(=O)C(=Cc2ccc(c(c2)OC)OCc2ccc(cc2)C(=O)O)C(=O)N(C1=S)CC
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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/c1-4-25-21(27)18(22(28)26(5-2)24(25)33)12-16-8-11-19(20(13-16)31-3)32-14-15-6-9-17(10-7-15)23(29)30/h6-13H,4-5,14H2,1-3H3,(H,29,30)InChIKey
WCTCYMXNRMFGHJ-UHFFFAOYSA-NSynonyms
4((4((13DIETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
4((4((13DIETHYL46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
CCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)C(=O)O)OC)C(=O)N(C1=S)CC
InChI=1SC24H24N2O6Sc142521(27)18(22(28)26(52)24(25)33)121681119(20(1316)313)3214156917(10715)23(29)30h613H4514H213H3(H2930)
MFCD03706453
ZINC000009258963
ZINC9258963
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