Vitas-M small molecule compound
(5Z)-5-(3-bromo-4-ethoxybenzylidene)-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK042154
SMILES CCOc1ccc(cc1Br)/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 C19H14BrFN2O3S MW 449.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrFN2O3S/c1-2-26-16-8-3-11(10-15(16)20)9-14-17(24)22-19(27)23(18(14)25)13-6-4-12(21)5-7-13/h3-10H,2H2,1H3,(H,22,24,27)/b14-9-InChIKey
AZDXPKHYQUUGRX-ZROIWOOFSA-NSynonyms
(5Z)5((3bromo4ethoxyphenyl)methylidene)1(4fluorophenyl)2sulfanylidene13diazinane46dione
(5Z)5(3BROMO4ETHOXYBENZYLIDENE)1(4FLUOROPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCOC1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F)Br
CCOc1ccc(cc1Br)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
InChI=1SC19H14BrFN2O3Sc1226168311(1015(16)20)91417(24)2219(27)23(18(14)25)136412(21)5713h310H2H21H3(H222427)b149
MFCD03228511
STK042154
ZINC000009311658
ZINC09311658
ZINC9311658
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