Vitas-M small molecule compound

3-methyl-7-(3-methylbutyl)-8-(prop-2-en-1-ylamino)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK839999
SMILES C=CCNc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C

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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 C14H21N5O2 MW 291.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N5O2/c1-5-7-15-13-16-11-10(19(13)8-6-9(2)3)12(20)17-14(21)18(11)4/h5,9H,1,6-8H2,2-4H3,(H,15,16)(H,17,20,21)
InChIKey
LMEWKNDYUKISGY-UHFFFAOYSA-N
Synonyms

3methyl7(3methylbutyl)8(prop2en1ylamino)37dihydro1Hpurine26dione
3METHYL7(3METHYLBUTYL)8(PROP2ENYLAMINO)137TRIHYDROPURINE26DIONE
3METHYL7(3METHYLBUTYL)8(PROP2ENYLAMINO)PURINE26DIONE
8(allylamino)7isopentyl3methyl1Hpurine26(3H7H)dione
8ALLYLAMINO3METHYL7(3METHYLBUTYL)37DIHYDROPURINE26DIONE
C=CCNc1nc2c(n1CCC(C)C)c(=O)(nH)c(=O)n2C
CC(C)CCN1C2=C(N=C1NCC=C)N(C(=O)NC2=O)C
InChI=1SC14H21N5O2c1571513161110(19(13)869(2)3)12(20)1714(21)18(11)4h59H168H224H3(H1516)(H172021)
MFCD02737568
ZINC000012382243
ZINC12382243

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Available files

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