SYNTHON-LAB SL040549

pro_cas
pro_cdbregno
CCD03281987
pro_formula
C33 H25 Cl N2 O7 S
pro_molWeight
629.086

basic_info

Product_Name: SYNTHON-LAB SL040549
EnglishSynonyms: SYNTHON-LAB SL040549
pro_mdlNumber: MFCD17010299
pro_acceptors: 9
pro_donors: 2
pro_smile: COc1cc(cc(c1OCc2cccc(c2)C(=O)O)Cl)/C=C/3\C(=O)N(/C(=N/c4ccccc4)/S3)Cc5ccc(cc5)C(=O)O
InChi: InChI=1S/C33H25ClN2O7S/c1-42-27-16-22(15-26(34)29(27)43-19-21-6-5-7-24(14-21)32(40)41)17-28-30(37)36(18-20-10-12-23(13-11-20)31(38)39)33(44-28)35-25-8-3-2-4-9-25/h2-17H,18-19H2,1H3,(H,38,39)(H,40,41)/b28-17+,35-33-
InChiKey: InChIKey=ATNAAZUNATUCJV-UIYPCOOHSA-N

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