Vitas-M small molecule compound
(5Z)-5-[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)benzylidene]-1-(4-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK196986
SMILES C=CCc1cc(/C=C\2/C(=O)NC(=S)N(C2=O)c2ccc(cc2)OC)cc(c1OC)OCC
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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 C24H24N2O5S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O5S/c1-5-7-16-12-15(14-20(31-6-2)21(16)30-4)13-19-22(27)25-24(32)26(23(19)28)17-8-10-18(29-3)11-9-17/h5,8-14H,1,6-7H2,2-4H3,(H,25,27,32)/b19-13-InChIKey
VTOPZBGWMLZZOJ-UYRXBGFRSA-NSynonyms
(5Z)5((3ETHOXY4METHOXY5PROP2ENYLPHENYL)METHYLIDENE)1(4METHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)5(3ETHOXY4METHOXY5(PROP2EN1YL)BENZYLIDENE)1(4METHOXYPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C=CCc1cc(C=C2C(=O)NC(=S)N(C2=O)c2ccc(cc2)OC)cc(c1OC)OCC
CCOC1=CC(=CC(=C1OC)CC=C)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)OC
InChI=1SC24H24N2O5Sc157161215(1420(3162)21(16)304)131922(27)2524(32)26(23(19)28)1781018(293)11917h5814H167H224H3(H252732)b1913
MFCD06666500
ZINC000012363668
ZINC12363668
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