Vitas-M small molecule compound
5-{2-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK018136
SMILES CCc1cc(OCCOc2ccccc2C=C2C(=O)NC(=S)NC2=O)cc(c1)C
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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 C22H22N2O4S MW 410.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O4S/c1-3-15-10-14(2)11-17(12-15)27-8-9-28-19-7-5-4-6-16(19)13-18-20(25)23-22(29)24-21(18)26/h4-7,10-13H,3,8-9H2,1-2H3,(H2,23,24,25,26,29)InChIKey
DLVHLYYPRLZYBF-UHFFFAOYSA-NSynonyms
5((2(2(3ETHYL5METHYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(2(2(3ETHYL5METHYLPHENOXY)ETHOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCC1=CC(=CC(=C1)C)OCCOC2=CC=CC=C2C=C3C(=O)NC(=S)NC3=O
CCc1cc(OCCOc2ccccc2C=C2C(=O)NC(=S)NC2=O)cc(c1)C
InChI=1SC22H22N2O4Sc13151014(2)1117(1215)27892819754616(19)131820(25)2322(29)2421(18)26h471013H389H212H3(H22324252629)
MFCD02017746
STK018136
ZINC000002947549
ZINC02947549
ZINC2947549
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