Vitas-M small molecule compound
8-[benzyl(methyl)amino]-7-[(2E)-but-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK856998
SMILES C/C=C/Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)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 C18H21N5O2 MW 339.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O2/c1-4-5-11-23-14-15(22(3)18(25)20-16(14)24)19-17(23)21(2)12-13-9-7-6-8-10-13/h4-10H,11-12H2,1-3H3,(H,20,24,25)/b5-4+InChIKey
UFEBCZQYCHFGTD-SNAWJCMRSA-NSynonyms
1164563-74-9(E)8(benzyl(methyl)amino)7(but2en1yl)3methyl1Hpurine26(3H7H)dione
1164563749
7((E)BUT2ENYL)3METHYL8(METHYL(PHENYLMETHYL)AMINO)PURINE26DIONE
8(benzyl(methyl)amino)7((2E)but2en1yl)3methyl37dihydro1Hpurine26dione
8(BENZYL(METHYL)AMINO)7((E)BUT2ENYL)3METHYLPURINE26DIONE
8(BENZYL(METHYL)AMINO)7((E)BUT2ENYL)3METHYLXANTHINE
8(BENZYLMETHYLAMINO)7BUT2ENYL3METHYL37DIHYDROPURINE26DIONE
CC=CCn1c(nc2c1c(=O)(nH)c(=O)n2C)N(Cc1ccccc1)C
CC=CCN1C2=C(N=C1N(C)CC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC18H21N5O2c14511231415(22(3)18(25)2016(14)24)1917(23)21(2)121397681013h410H1112H213H3(H202425)b54+
MFCD02736161
ZINC000013131204
ZINC13131204
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