basic_info |
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| Product_Name: | 2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 531515-27-2 |
| EnglishSynonyms: | BENZOIC ACID, 2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 2-[[[(2-CHLORO-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03565466 |
| pro_acceptors: | 8 |
| pro_donors: | 3 |
| pro_smile: | c1ccc(c(c1)C(=O)O)NC(=S)NC(=O)c2ccc(cc2Cl)[N+](=O)[O-] |
| InChi: | InChI=1S/C15H10ClN3O5S/c16-11-7-8(19(23)24)5-6-9(11)13(20)18-15(25)17-12-4-2-1-3-10(12)14(21)22/h1-7H,(H,21,22)(H2,17,18,20,25) |
| InChiKey: | InChIKey=OHVRZFNNEYBALM-UHFFFAOYSA-N |
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