Vitas-M small molecule compound
(5E)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1-(4-methoxyphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STK855370
SMILES COc1ccc(cc1)N1C(=NC(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/C1=O)S
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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 C24H20N4O5S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O5S/c1-14-12-16(15(2)26(14)17-4-6-19(7-5-17)28(31)32)13-21-22(29)25-24(34)27(23(21)30)18-8-10-20(33-3)11-9-18/h4-13H,1-3H3,(H,25,29,34)/b21-13+InChIKey
IPFJMYFPCFPUAB-FYJGNVAPSA-NSynonyms
COc1ccc(cc1)N1C(=NC(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)(N+)(=O)(O))C)C1=O)S
MFCD08730700
ZINC000008997536
Check stock
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Check stock on Vitas-MAvailable files
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