basic_info |
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| Product_Name: | 4-CHLORO-3-[[[(3,5-DINITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 530146-17-9 |
| EnglishSynonyms: | BENZOIC ACID, 4-CHLORO-3-[[[(3,5-DINITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 4-CHLORO-3-[[[(3,5-DINITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03564660 |
| pro_acceptors: | 11 |
| pro_donors: | 3 |
| pro_smile: | c1cc(c(cc1C(=O)O)NC(=S)NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])Cl |
| InChi: | InChI=1S/C15H9ClN4O7S/c16-11-2-1-7(14(22)23)5-12(11)17-15(28)18-13(21)8-3-9(19(24)25)6-10(4-8)20(26)27/h1-6H,(H,22,23)(H2,17,18,21,28) |
| InChiKey: | InChIKey=RHGXSCSXCFPGGG-UHFFFAOYSA-N |
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