basic_info |
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| Product_Name: | 2-AMINO-4-(4-BROMO-2-THIENYL)-5-OXO-1-[3-(TRIFLUOROMETHYL)PHENYL]-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE |
| CAS: | 339318-76-2 |
| EnglishSynonyms: | 2-AMINO-4-(4-BROMO-2-THIENYL)-5-OXO-1-[3-(TRIFLUOROMETHYL)PHENYL]-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE |
| pro_mdlNumber: | MFCD00827214 |
| pro_acceptors: | 4 |
| pro_donors: | 1 |
| pro_smile: | c1cc(cc(c1)N2C3=C(C(C(=C2N)C#N)c4cc(cs4)Br)C(=O)CCC3)C(F)(F)F |
| InChi: | InChI=1S/C21H15BrF3N3OS/c22-12-8-17(30-10-12)18-14(9-26)20(27)28(15-5-2-6-16(29)19(15)18)13-4-1-3-11(7-13)21(23,24)25/h1,3-4,7-8,10,18H,2,5-6,27H2 |
| InChiKey: | InChIKey=ZODNQRNZCCDKSB-UHFFFAOYSA-N |
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