Vitas-M small molecule compound
(5Z)-5-[1-acetyl-5-(1,3-benzodioxol-5-yl)pyrazolidin-3-ylidene]-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Catalog ID
STK603597
SMILES CC(=O)N1N/C(=C\2/C(=NC(=O)N(C2=O)C)O)/CC1c1ccc2c(c1)OCO2
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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 C17H16N4O6 MW 372.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O6/c1-8(22)21-11(9-3-4-12-13(5-9)27-7-26-12)6-10(19-21)14-15(23)18-17(25)20(2)16(14)24/h3-5,11,19H,6-7H2,1-2H3,(H,18,23,25)/b14-10-InChIKey
CVZKACGDROQOOQ-UVTDQMKNSA-NSynonyms
(5Z)5(1acetyl5(13benzodioxol5yl)pyrazolidin3ylidene)1methyl13diazinane246trione
(5Z)5(1acetyl5(13benzodioxol5yl)pyrazolidin3ylidene)6hydroxy3methylpyrimidine24(3H5H)dione
CC(=O)N1C(CC(=C2C(=O)NC(=O)N(C2=O)C)N1)C3=CC4=C(C=C3)OCO4
CC(=O)N1NC(=C2C(=NC(=O)N(C2=O)C)O)CC1c1ccc2c(c1)OCO2
InChI=1SC17H16N4O6c18(22)2111(9341213(59)2772612)610(1921)1415(23)1817(25)20(2)16(14)24h351119H67H212H3(H182325)b1410
MFCD08736393
ZINC000008766492
ZINC000008766493
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