Vitas-M small molecule compound
8-benzyl-7-(4-heptylphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Catalog ID
STK689763
SMILES CCCCCCCc1ccc(cc1)c1cn2c(n1Cc1ccccc1)nc1c2c(=O)n(C)c(=O)n1C
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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 C29H33N5O2 MW 483.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O2/c1-4-5-6-7-9-12-21-15-17-23(18-16-21)24-20-34-25-26(31(2)29(36)32(3)27(25)35)30-28(34)33(24)19-22-13-10-8-11-14-22/h8,10-11,13-18,20H,4-7,9,12,19H2,1-3H3InChIKey
ZQVGXJQQRAULAW-UHFFFAOYSA-NSynonyms
6benzyl7(4heptylphenyl)24dimethylpurino(78a)imidazole13dione
8benzyl7(4heptylphenyl)13dimethyl1Himidazo(21f)purine24(3H8H)dione
CCCCCCCC1=CC=C(C=C1)C2=CN3C4=C(N=C3N2CC5=CC=CC=C5)N(C(=O)N(C4=O)C)C
InChI=1SC29H33N5O2c1456791221151723(181621)2420342526(31(2)29(36)32(3)27(25)35)3028(34)33(24)192213108111422h81011131820H4791219H213H3
MFCD09062820
ZINC000095597857
ZINC95597857
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