Vitas-M small molecule compound
(5E)-5-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-1-(2-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK196971
SMILES COc1ccc2c(c1)c(/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1F)c(cc2)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 C23H17FN2O4S MW 436.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FN2O4S/c1-29-14-9-7-13-8-10-20(30-2)16(15(13)11-14)12-17-21(27)25-23(31)26(22(17)28)19-6-4-3-5-18(19)24/h3-12H,1-2H3,(H,25,27,31)/b17-12+InChIKey
ZTRPFITYRDPSIX-SFQUDFHCSA-NSynonyms
(5E)5((27DIMETHOXYNAPHTHALEN1YL)METHYLIDENE)1(2FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5((27DIMETHOXYNAPHTHALEN1YL)METHYLIDENE)1(2FLUOROPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5((27DIMETHOXYNAPHTHYL)METHYLENE)1(2FLUOROPHENYL)2THIOXO13DIHYDROPYRIMIDINE46DIONE
COC1=CC2=C(C=C1)C=CC(=C2C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC=C4F)OC
COc1ccc2c(c1)c(C=C1C(=O)NC(=S)N(C1=O)c1ccccc1F)c(cc2)OC
InChI=1SC23H17FN2O4Sc12914971381020(302)16(15(13)1114)121721(27)2523(31)26(22(17)28)19643518(19)24h312H12H3(H252731)b1712+
MFCD03548820
ZINC000009259181
ZINC09259181
ZINC9259181
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