Vitas-M small molecule compound
(5Z)-1-[4-(butan-2-yl)phenyl]-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK712593
SMILES CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O)C
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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 C25H21N3O6 MW 459.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O6/c1-3-15(2)16-7-9-18(10-8-16)27-24(30)21(23(29)26-25(27)31)14-20-11-12-22(34-20)17-5-4-6-19(13-17)28(32)33/h4-15H,3H2,1-2H3,(H,26,29,31)/b21-14-InChIKey
ZZWMBDDHFVCXGS-STZFKDTASA-NSynonyms
799800-07-0(5Z)1(4(butan2yl)phenyl)5((5(3nitrophenyl)furan2yl)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4BUTAN2YLPHENYL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(4(secbutyl)phenyl)5((5(3nitrophenyl)furan2yl)methylene)pyrimidine246(1H3H5H)trione
799800070
CCC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)NC2=O
CCC(c1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))C1=O)C
InChI=1SC25H21N3O6c1315(2)167918(10816)2724(30)21(23(29)2625(27)31)1420111222(3420)1754619(1317)28(32)33h415H3H212H3(H262931)b2114
MFCD03678143
ZINC000009427769
ZINC000013685950
Check stock
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Check stock on Vitas-MAvailable files
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