Vitas-M small molecule compound
(8Z)-8-[(2E)-(1,3-benzodioxol-5-ylmethylidene)hydrazinylidene]-1,3,7-trimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Catalog ID
STK599699
SMILES Cn1/c(=N\N=C\c2ccc3c(c2)OCO3)/[nH]c2c1c(=O)n(c(=O)n2C)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 C16H16N6O4 MW 356.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6O4/c1-20-12-13(21(2)16(24)22(3)14(12)23)18-15(20)19-17-7-9-4-5-10-11(6-9)26-8-25-10/h4-7H,8H2,1-3H3,(H,18,19)/b17-7+InChIKey
NDKAWFGGWBPEJV-REZTVBANSA-NSynonyms
6632-73-1(8Z)8((2E)(13benzodioxol5ylmethylidene)hydrazinylidene)137trimethyl3789tetrahydro1Hpurine26dione
6632731
8((2E)2(13benzodioxol5ylmethylidene)hydrazinyl)137trimethylpurine26dione
Cn1c(=NN=Cc2ccc3c(c2)OCO3)(nH)c2c1c(=O)n(c(=O)n2C)C
CN1C2=C(N=C1NN=CC3=CC4=C(C=C3)OCO4)N(C(=O)N(C2=O)C)C
InChI=1SC16H16N6O4c1201213(21(2)16(24)22(3)14(12)23)1815(20)191779451011(69)2682510h47H8H213H3(H1819)b177+
MFCD18158578
ZINC000005201028
ZINC31628452
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