Vitas-M small molecule compound
5-{3-ethoxy-4-[(4-methylbenzyl)oxy]-5-(prop-2-en-1-yl)benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK007969
SMILES CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCc1ccc(cc1)C)CC=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 C24H24N2O4S MW 436.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O4S/c1-4-6-18-11-17(12-19-22(27)25-24(31)26-23(19)28)13-20(29-5-2)21(18)30-14-16-9-7-15(3)8-10-16/h4,7-13H,1,5-6,14H2,2-3H3,(H2,25,26,27,28,31)InChIKey
VNUKCDMZOASYJE-UHFFFAOYSA-NSynonyms
5((3ETHOXY4((4METHYLPHENYL)METHOXY)5PROP2ENYLPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(3ETHOXY4((4METHYLBENZYL)OXY)5(PROP2EN1YL)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C)CC=C)C=C3C(=O)NC(=S)NC3=O
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(c1OCc1ccc(cc1)C)CC=C
InChI=1SC24H24N2O4Sc146181117(121922(27)2524(31)2623(19)28)1320(2952)21(18)3014169715(3)81016h4713H15614H223H3(H22526272831)
MFCD03993713
STK007969
ZINC000001124797
ZINC01124797
ZINC1124797
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