basic_info |
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| Product_Name: | 3,5-DICHLORO-2-[[[(4-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 533919-58-3 |
| EnglishSynonyms: | BENZOIC ACID, 3,5-DICHLORO-2-[[[(4-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 3,5-DICHLORO-2-[[[(4-METHYL-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03568923 |
| pro_acceptors: | 8 |
| pro_donors: | 3 |
| pro_smile: | Cc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc2c(cc(cc2Cl)Cl)C(=O)O |
| InChi: | InChI=1S/C16H11Cl2N3O5S/c1-7-2-3-8(4-12(7)21(25)26)14(22)20-16(27)19-13-10(15(23)24)5-9(17)6-11(13)18/h2-6H,1H3,(H,23,24)(H2,19,20,22,27) |
| InChiKey: | InChIKey=OOLWQWNCHTYPAH-UHFFFAOYSA-N |
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