Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-8-(dimethylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL512387
SMILES C/C=C/Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)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 C12H17N5O2 MW 263.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17N5O2/c1-5-6-7-17-8-9(13-11(17)15(2)3)16(4)12(19)14-10(8)18/h5-6H,7H2,1-4H3,(H,14,18,19)/b6-5+InChIKey
FJCMRXQLSSVTPS-AATRIKPKSA-NSynonyms
303973-90-2(E)7(BUT2EN1YL)8(DIMETHYLAMINO)3METHYL1HPURINE26(3H7H)DIONE
303973902
5742118
7((~(E))but2enyl)8(dimethylamino)3methylpurine26dione
7((2E)but2en1yl)8(dimethylamino)3methyl37dihydro1Hpurine26dione
7((2E)BUT2ENYL)8(DIMETHYLAMINO)3METHYL137TRIHYDROPURINE26DIONE
7((E)BUT2ENYL)8(DIMETHYLAMINO)3METHYLPURINE26DIONE
7BUT2ENYL8DIMETHYLAMINO3METHYL37DIHYDROPURINE26DIONE
CC=CCn1c(nc2c1c(=O)(nH)c(=O)n2C)N(C)C
InChI=1SC12H17N5O2c15671789(1311(17)15(2)3)16(4)12(19)1410(8)18h56H7H214H3(H141819)b65+
MFCD01547025
ZINC000012343362
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