basic_info |
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| Product_Name: | ME 2-((((2,2,2-TRICHLORO-1-(HEPTANOYLAMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOATE |
| EnglishSynonyms: | ME 2-((((2,2,2-TRICHLORO-1-(HEPTANOYLAMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOATE |
| pro_mdlNumber: | MFCD00349735 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | CCCCCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)Nc1ccccc1C(=O)OC |
| InChi: | InChI=1S/C18H24Cl3N3O3S/c1-3-4-5-6-11-14(25)23-16(18(19,20)21)24-17(28)22-13-10-8-7-9-12(13)15(26)27-2/h7-10,16H,3-6,11H2,1-2H3,(H,23,25)(H2,22,24,28) |
| InChiKey: | InChIKey=NHUKNEVZDXEQPP-UHFFFAOYSA-N |
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