basic_info |
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| Product_Name: | 5-CHLORO-2-[[[(2-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 535946-94-2 |
| EnglishSynonyms: | 5-CHLORO-2-[[[(2-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 5-CHLORO-2-[[[(2-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- |
| pro_mdlNumber: | MFCD03571916 |
| pro_acceptors: | 8 |
| pro_donors: | 3 |
| pro_smile: | c1ccc(c(c1)C(=O)NC(=S)Nc2ccc(cc2C(=O)O)Cl)[N+](=O)[O-] |
| InChi: | InChI=1S/C15H10ClN3O5S/c16-8-5-6-11(10(7-8)14(21)22)17-15(25)18-13(20)9-3-1-2-4-12(9)19(23)24/h1-7H,(H,21,22)(H2,17,18,20,25) |
| InChiKey: | InChIKey=NYCMRYWZXRNFMK-UHFFFAOYSA-N |
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