basic_info |
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Product_Name: | 5-(ADAMANTANE-1-CARBONYL)-4-AMINO-1-(4-BROMOPHENYL)-2-METHYLPYRROLE-3-CARBONITRILE |
EnglishSynonyms: | 5-(ADAMANTANE-1-CARBONYL)-4-AMINO-1-(4-BROMOPHENYL)-2-METHYLPYRROLE-3-CARBONITRILE |
pro_mdlNumber: | MFCD01859547 |
pro_acceptors: | 4 |
pro_donors: | 1 |
pro_smile: | Cc1c(c(c(n1c2ccc(cc2)Br)C(=O)[C@@]34C[C@H]5C[C@@H](C3)C[C@H](C5)C4)N)C#N |
InChi: | InChI=1S/C23H24BrN3O/c1-13-19(12-25)20(26)21(27(13)18-4-2-17(24)3-5-18)22(28)23-9-14-6-15(10-23)8-16(7-14)11-23/h2-5,14-16H,6-11,26H2,1H3/t14-,15+,16-,23- |
InChiKey: | InChIKey=ZAZGPSFUYLVTJS-FSUVMKLBSA-N |
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