Vitas-M small molecule compound
(5E)-3-(3,5-dimethylphenyl)-6-hydroxy-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK854797
SMILES Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O)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 C23H17N3O6 MW 431.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O6/c1-13-8-14(2)10-17(9-13)25-22(28)19(21(27)24-23(25)29)12-18-6-7-20(32-18)15-4-3-5-16(11-15)26(30)31/h3-12H,1-2H3,(H,24,27,29)/b19-12+InChIKey
IMOCWIUPCKLPPU-XDHOZWIPSA-NSynonyms
(5E)1(35DIMETHYLPHENYL)5((5(3NITROPHENYL)FURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)3(35dimethylphenyl)6hydroxy5((5(3nitrophenyl)furan2yl)methylidene)pyrimidine24(3H5H)dione
1(35DIMETHYLPHENYL)5((5(3NITROPHENYL)(2FURYL))METHYLENE)13DIHYDROPYRIMIDINE246TRIONE
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)NC2=O)C
Cc1cc(C)cc(c1)N1C(=O)N=C(C(=Cc2ccc(o2)c2cccc(c2)(N+)(=O)(O))C1=O)O
InChI=1SC23H17N3O6c113814(2)1017(913)2522(28)19(21(27)2423(25)29)12186720(3218)1543516(1115)26(30)31h312H12H3(H242729)b1912+
MFCD08735918
ZINC000008743156
ZINC8743156
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