Vitas-M small molecule compound
(5E)-1-(2,3-dimethylphenyl)-5-(4-ethoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK195597
SMILES CCOc1ccc(cc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1C)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 C21H20N2O3S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3S/c1-4-26-16-10-8-15(9-11-16)12-17-19(24)22-21(27)23(20(17)25)18-7-5-6-13(2)14(18)3/h5-12H,4H2,1-3H3,(H,22,24,27)/b17-12+InChIKey
WGKGBVCPRDPGJV-SFQUDFHCSA-NSynonyms
(5E)1(23DIMETHYLPHENYL)5((4ETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(23DIMETHYLPHENYL)5(4ETHOXYBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
1(23DIMETHYLPHENYL)5(4ETHOXYBENZYLIDENE)2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CCOC1=CC=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3C)C
CCOc1ccc(cc1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
InChI=1SC21H20N2O3Sc14261610815(91116)121719(24)2221(27)23(20(17)25)1875613(2)14(18)3h512H4H213H3(H222427)b1712+
MFCD03923473
ZINC000000664577
ZINC00664577
ZINC664577
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