Vitas-M small molecule compound
(5E)-5-[4-(diethylamino)-2-hydroxybenzylidene]-1-(2,5-dimethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK090784
SMILES COc1ccc(c(c1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2O)N(CC)CC)/C1=O)OC
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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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-5-25(6-2)15-8-7-14(19(27)12-15)11-17-21(28)24-23(32)26(22(17)29)18-13-16(30-3)9-10-20(18)31-4/h7-13,27H,5-6H2,1-4H3,(H,24,28,32)/b17-11+InChIKey
RJQICGLRFVSXSK-GZTJUZNOSA-NSynonyms
346637-08-9(5E)5((4(DIETHYLAMINO)2HYDROXYPHENYL)METHYLIDENE)1(25DIMETHOXYPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4(DIETHYLAMINO)2HYDROXYBENZYLIDENE)1(25DIMETHOXYPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(E)5(4(diethylamino)2hydroxybenzylidene)1(25dimethoxyphenyl)2thioxodihydropyrimidine46(1H5H)dione
346637089
CCN(CC)C1=CC(=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=C(C=CC(=C3)OC)OC)O
COc1ccc(c(c1)N1C(=S)NC(=O)C(=Cc2ccc(cc2O)N(CC)CC)C1=O)OC
InChI=1SC23H25N3O5Sc1525(62)158714(19(27)1215)111721(28)2423(32)26(22(17)29)181316(303)91020(18)314h71327H56H214H3(H242832)b1711+
MFCD01559873
STK090784
ZINC000001444034
ZINC01444034
ZINC1444034
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.