Vitas-M small molecule compound
(5E)-1-(4-fluorophenyl)-5-[(2E)-3-(4-methoxyphenyl)prop-2-en-1-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187487
SMILES COc1ccc(cc1)/C=C/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
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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 C20H15FN2O3S MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O3S/c1-26-16-11-5-13(6-12-16)3-2-4-17-18(24)22-20(27)23(19(17)25)15-9-7-14(21)8-10-15/h2-12H,1H3,(H,22,24,27)/b3-2+,17-4+InChIKey
WNYCYGDLSVIZMN-GFJWLWTISA-NSynonyms
(5E)1(4FLUOROPHENYL)5((2E)3(4METHOXYPHENYL)PROP2EN1YLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(4FLUOROPHENYL)5((E)3(4METHOXYPHENYL)PROP2ENYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
COC1=CC=C(C=C1)C=CC=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F
COc1ccc(cc1)C=CC=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
InChI=1SC20H15FN2O3Sc1261611513(61216)3241718(24)2220(27)23(19(17)25)159714(21)81015h212H1H3(H222427)b32+174+
MFCD03715353
ZINC000001147709
ZINC01147709
ZINC1147709
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