basic_info |
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| Product_Name: | 3-((4-(2-PYRIDYLTHIO)PHENYL)AMINO)CYCLOHEX-2-EN-1-ONE |
| CAS: | 634155-00-3 |
| EnglishSynonyms: | 3-[4-(2-PYRIDINYLSULFANYL)ANILINO]-2-CYCLOHEXEN-1-ONE ; 3-((4-(2-PYRIDYLTHIO)PHENYL)AMINO)CYCLOHEX-2-EN-1-ONE |
| pro_mdlNumber: | MFCD00171167 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | c1ccnc(c1)Sc2ccc(cc2)NC3=CC(=O)CCC3 |
| InChi: | InChI=1S/C17H16N2OS/c20-15-5-3-4-14(12-15)19-13-7-9-16(10-8-13)21-17-6-1-2-11-18-17/h1-2,6-12,19H,3-5H2 |
| InChiKey: | InChIKey=AOFUKJAWMDOXKD-UHFFFAOYSA-N |
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