8-(1H-BENZOIMIDAZOL-2-YLSULFANYL)-3-METHYL-7-OCTYL-3,7-DIHYDRO-PURINE-2,6-DIONE

pro_cas
pro_cdbregno
CCD08047758
pro_formula
C21 H26 N6 O2 S
pro_molWeight
426.542

basic_info

Product_Name: 8-(1H-BENZOIMIDAZOL-2-YLSULFANYL)-3-METHYL-7-OCTYL-3,7-DIHYDRO-PURINE-2,6-DIONE
EnglishSynonyms: 8-(1H-BENZOIMIDAZOL-2-YLSULFANYL)-3-METHYL-7-OCTYL-3,7-DIHYDRO-PURINE-2,6-DIONE
pro_mdlNumber: MFCD00612627
pro_acceptors: 8
pro_donors: 2
pro_smile: CCCCCCCCn1c2c(=O)[nH]c(=O)n(c2nc1Sc3[nH]c4ccccc4n3)C
InChi: InChI=1S/C21H26N6O2S/c1-3-4-5-6-7-10-13-27-16-17(26(2)20(29)25-18(16)28)24-21(27)30-19-22-14-11-8-9-12-15(14)23-19/h8-9,11-12H,3-7,10,13H2,1-2H3,(H,22,23)(H,25,28,29)
InChiKey: InChIKey=LQMMJPIPGXAMJW-UHFFFAOYSA-N

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