Vitas-M small molecule compound
(5E)-5-[4-(benzyloxy)-3-methoxy-5-(prop-2-en-1-yl)benzylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK025705
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2cc(OC)c(c(c2)CC=C)OCc2ccccc2)/C1=O
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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 C25H24N2O4S MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4S/c1-4-9-19-13-18(14-20-23(28)26-25(32)27(12-5-2)24(20)29)15-21(30-3)22(19)31-16-17-10-7-6-8-11-17/h4-8,10-11,13-15H,1-2,9,12,16H2,3H3,(H,26,28,32)/b20-14+InChIKey
GUJBKFAYCVLUBA-XSFVSMFZSA-NSynonyms
(5E)5((3METHOXY4PHENYLMETHOXY5PROP2ENYLPHENYL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4(BENZYLOXY)3METHOXY5(PROP2EN1YL)BENZYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCN1C(=S)NC(=O)C(=Cc2cc(OC)c(c(c2)CC=C)OCc2ccccc2)C1=O
COC1=CC(=CC(=C1OCC2=CC=CC=C2)CC=C)C=C3C(=O)NC(=S)N(C3=O)CC=C
InChI=1SC25H24N2O4Sc149191318(142023(28)2625(32)27(1252)24(20)29)1521(303)22(19)311617107681117h4810111315H1291216H23H3(H262832)b2014+
MFCD03707039
STK025705
ZINC000002995089
ZINC02995089
ZINC2995089
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