Vitas-M small molecule compound
(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK029068
SMILES Fc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2ccc3c(c2)OCO3)/C1=O
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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 C18H11FN2O4S MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11FN2O4S/c19-11-2-4-12(5-3-11)21-17(23)13(16(22)20-18(21)26)7-10-1-6-14-15(8-10)25-9-24-14/h1-8H,9H2,(H,20,22,26)/b13-7+InChIKey
QYVDCJXFYUVUGI-NTUHNPAUSA-NSynonyms
(5E)5(13BENZODIOXOL5YLMETHYLIDENE)1(4FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(13BENZODIOXOL5YLMETHYLIDENE)1(4FLUOROPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5(2HBENZO(34D)13DIOXOLAN5YLMETHYLENE)1(4FLUOROPHENYL)2THIOXO13DIHYDROPYRIMIDINE46DIONE
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc3c(c2)OCO3)C1=O
InChI=1SC18H11FN2O4Sc19112412(5311)2117(23)13(16(22)2018(21)26)710161415(810)2592414h18H9H2(H202226)b137+
MFCD02108427
STK029068
ZINC000001213542
ZINC01213542
ZINC1213542
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