Vitas-M small molecule compound
5-{5-bromo-2-[2-(4-cyclohexylphenoxy)ethoxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK385462
SMILES S=C1NC(=O)C(=Cc2cc(Br)ccc2OCCOc2ccc(cc2)C2CCCCC2)C(=O)N1
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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 C25H25BrN2O4S MW 529.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN2O4S/c26-19-8-11-22(18(14-19)15-21-23(29)27-25(33)28-24(21)30)32-13-12-31-20-9-6-17(7-10-20)16-4-2-1-3-5-16/h6-11,14-16H,1-5,12-13H2,(H2,27,28,29,30,33)InChIKey
XHUKWSRZTVGIJD-UHFFFAOYSA-NSynonyms
5((5BROMO2(2(4CYCLOHEXYLPHENOXY)ETHOXY)PHENYL)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5((5BROMO2(2(4CYCLOHEXYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5((5BROMO2(2(4CYCLOHEXYLPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5(5BROMO2(2(4CYCLOHEXYLPHENOXY)ETHOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1CCC(CC1)C2=CC=C(C=C2)OCCOC3=C(C=C(C=C3)Br)C=C4C(=O)NC(=S)NC4=O
InChI=1SC25H25BrN2O4Sc261981122(18(1419)152123(29)2725(33)2824(21)30)32131231209617(71020)164213516h6111416H151213H2(H22728293033)
MFCD02067673
ZINC000033353550
ZINC33353550
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