basic_info |
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| Product_Name: | 3-PYRIDINECARBONITRILE, 1,4-DIHYDRO-5-ACETYL-6-METHYL-2-(METHYLTHIO)-4-PHENYL- |
| CAS: | 117509-71-4 |
| EnglishSynonyms: | 3-PYRIDINECARBONITRILE, 1,4-DIHYDRO-5-ACETYL-6-METHYL-2-(METHYLTHIO)-4-PHENYL- ; 1,4-DIHYDRO-5-ACETYL-6-METHYL-2-(METHYLTHIO)-4-PHENYL-3-PYRIDINECARBONITRILE |
| pro_mdlNumber: | MFCD00589166 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | CC1=C(C(C(=C(N1)SC)C#N)c2ccccc2)C(=O)C |
| InChi: | InChI=1S/C16H16N2OS/c1-10-14(11(2)19)15(12-7-5-4-6-8-12)13(9-17)16(18-10)20-3/h4-8,15,18H,1-3H3 |
| InChiKey: | InChIKey=JFSDHMISHAZGDL-UHFFFAOYSA-N |
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