Vitas-M small molecule compound
3-methyl-7-(3-methylbenzyl)-8-(prop-2-en-1-ylamino)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK839172
SMILES C=CCNc1nc2c(n1Cc1cccc(c1)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 C17H19N5O2 MW 325.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O2/c1-4-8-18-16-19-14-13(15(23)20-17(24)21(14)3)22(16)10-12-7-5-6-11(2)9-12/h4-7,9H,1,8,10H2,2-3H3,(H,18,19)(H,20,23,24)InChIKey
XNSVZGWHOCXOMJ-UHFFFAOYSA-NSynonyms
377055-79-3377055793
3METHYL7((3METHYLPHENYL)METHYL)8(PROP2ENYLAMINO)137TRIHYDROPURINE26DIONE
3METHYL7((3METHYLPHENYL)METHYL)8(PROP2ENYLAMINO)PURINE26DIONE
3methyl7(3methylbenzyl)8(prop2en1ylamino)37dihydro1Hpurine26dione
8(allylamino)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8ALLYLAMINO3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
C=CCNc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
CC1=CC(=CC=C1)CN2C3=C(N=C2NCC=C)N(C(=O)NC3=O)C
InChI=1SC17H19N5O2c1481816191413(15(23)2017(24)21(14)3)22(16)101275611(2)912h479H1810H223H3(H1819)(H202324)
MFCD02736157
ZINC000012647451
ZINC12647451
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