Vitas-M small molecule compound
(5E)-1-(3-fluorophenyl)-5-[(2E)-3-(4-methoxyphenyl)prop-2-en-1-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187325
SMILES COc1ccc(cc1)/C=C/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)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/c1-26-16-10-8-13(9-11-16)4-2-7-17-18(24)22-20(27)23(19(17)25)15-6-3-5-14(21)12-15/h2-12H,1H3,(H,22,24,27)/b4-2+,17-7+InChIKey
CUVOGYYDQAYINR-VXTNGOHYSA-NSynonyms
(5E)1(3FLUOROPHENYL)5((2E)3(4METHOXYPHENYL)PROP2EN1YLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(3FLUOROPHENYL)5((E)3(4METHOXYPHENYL)PROP2ENYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
1(3FLUOROPHENYL)5(3(4METHOXYPHENYL)PROP2ENYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
COC1=CC=C(C=C1)C=CC=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)F
COc1ccc(cc1)C=CC=C1C(=O)NC(=S)N(C1=O)c1cccc(c1)F
InChI=1SC20H15FN2O3Sc1261610813(91116)4271718(24)2220(27)23(19(17)25)1563514(21)1215h212H1H3(H222427)b42+177+
MFCD03699988
ZINC000000642056
ZINC00642056
ZINC642056
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