Vitas-M small molecule compound
3-methyl-7-octyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK540208
SMILES CCCCCCCCn1c(NCCc2ccccc2)nc2c1c(=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 C22H31N5O2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O2/c1-3-4-5-6-7-11-16-27-18-19(26(2)22(29)25-20(18)28)24-21(27)23-15-14-17-12-9-8-10-13-17/h8-10,12-13H,3-7,11,14-16H2,1-2H3,(H,23,24)(H,25,28,29)InChIKey
FFPRIZBXWGHKRO-UHFFFAOYSA-NSynonyms
376625-10-4376625104
3METHYL7OCTYL8((2PHENYLETHYL)AMINO)137TRIHYDROPURINE26DIONE
3methyl7octyl8((2phenylethyl)amino)37dihydro1Hpurine26dione
3methyl7octyl8(2phenylethylamino)purine26dione
3methyl7octyl8(phenethylamino)1Hpurine26(3H7H)dione
3METHYL7OCTYL8(PHENETHYLAMINO)PURINE26DIONE
CCCCCCCCn1c(NCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCN1C2=C(N=C1NCCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC22H31N5O2c1345671116271819(26(2)22(29)2520(18)28)2421(27)231514171298101317h8101213H37111416H212H3(H2324)(H252829)
MFCD02982387
ZINC000002284767
ZINC2284767
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