8-(3-BR-BENZYLSULFANYL)-7-(3-CL-BUT-2-ENYL)-3-ME-3,7-DIHYDRO-PURINE-2,6-DIONE

pro_cas
pro_cdbregno
CCD08063035
pro_formula
C17 H16 Br Cl N4 O2 S
pro_molWeight
455.762

basic_info

Product_Name: 8-(3-BR-BENZYLSULFANYL)-7-(3-CL-BUT-2-ENYL)-3-ME-3,7-DIHYDRO-PURINE-2,6-DIONE
EnglishSynonyms: 8-(3-BR-BENZYLSULFANYL)-7-(3-CL-BUT-2-ENYL)-3-ME-3,7-DIHYDRO-PURINE-2,6-DIONE
pro_mdlNumber: MFCD01079311
pro_acceptors: 6
pro_donors: 1
pro_smile: C/C(=C/Cn1c2c(=O)[nH]c(=O)n(c2nc1SCc3cccc(c3)Br)C)/Cl
InChi: InChI=1S/C17H16BrClN4O2S/c1-10(19)6-7-23-13-14(22(2)16(25)21-15(13)24)20-17(23)26-9-11-4-3-5-12(18)8-11/h3-6,8H,7,9H2,1-2H3,(H,21,24,25)/b10-6-
InChiKey: InChIKey=AHYQWOYGQKPIED-POHAHGRESA-N

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