Vitas-M small molecule compound
(5Z)-5-{[4-bromo-5-(morpholin-4-yl)furan-2-yl]methylidene}-1-(3,5-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170438
SMILES Cc1cc(C)cc(c1)N1C(=O)NC(=O)/C(=C/c2oc(c(c2)Br)N2CCOCC2)/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 C21H20BrN3O5 MW 474.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN3O5/c1-12-7-13(2)9-14(8-12)25-19(27)16(18(26)23-21(25)28)10-15-11-17(22)20(30-15)24-3-5-29-6-4-24/h7-11H,3-6H2,1-2H3,(H,23,26,28)/b16-10-InChIKey
NYIISRPAHNPUTM-YBEGLDIGSA-NSynonyms
(5Z)5((4BROMO5(MORPHOLIN4YL)FURAN2YL)METHYLIDENE)1(35DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((4BROMO5MORPHOLIN4YLFURAN2YL)METHYLIDENE)1(35DIMETHYLPHENYL)13DIAZINANE246TRIONE
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC(=C(O3)N4CCOCC4)Br)C(=O)NC2=O)C
Cc1cc(C)cc(c1)N1C(=O)NC(=O)C(=Cc2oc(c(c2)Br)N2CCOCC2)C1=O
InChI=1SC21H20BrN3O5c112713(2)914(812)2519(27)16(18(26)2321(25)28)10151117(22)20(3015)2435296424h711H36H212H3(H232628)b1610
MFCD02624516
ZINC000006768135
ZINC06768135
ZINC6768135
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