basic_info |
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| Product_Name: | METHYL 6-AMINO-4-(3-BROMOPHENYL)-5-CYANO-2-([(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]METHYL)-4H-PYRAN-3-CARBOXYLATE |
| EnglishSynonyms: | METHYL 6-AMINO-4-(3-BROMOPHENYL)-5-CYANO-2-([(3-CYANO-6,7,8,9-TETRAHYDRO-5H-CYCLOHEPTA[B]PYRIDIN-2-YL)SULFANYL]METHYL)-4H-PYRAN-3-CARBOXYLATE |
| pro_mdlNumber: | MFCD02326094 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | COC(=O)C1=C(OC(=C(C1c2cccc(c2)Br)C#N)N)CSc3c(cc4c(n3)CCCCC4)C#N |
| InChi: | InChI=1S/C26H23BrN4O3S/c1-33-26(32)23-21(34-24(30)19(13-29)22(23)16-7-5-8-18(27)11-16)14-35-25-17(12-28)10-15-6-3-2-4-9-20(15)31-25/h5,7-8,10-11,22H,2-4,6,9,14,30H2,1H3 |
| InChiKey: | InChIKey=KEDNMTNKCDWJDL-UHFFFAOYSA-N |
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