basic_info |
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| Product_Name: | 2-[[[[4-(1-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 535966-00-8 |
| EnglishSynonyms: | 2-[[[[4-(1-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 2-[[[[4-(1-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]- |
| pro_mdlNumber: | MFCD03572863 |
| pro_acceptors: | 6 |
| pro_donors: | 3 |
| pro_smile: | CCC(C)Oc1ccc(cc1)C(=O)NC(=S)Nc2ccccc2C(=O)O |
| InChi: | InChI=1S/C19H20N2O4S/c1-3-12(2)25-14-10-8-13(9-11-14)17(22)21-19(26)20-16-7-5-4-6-15(16)18(23)24/h4-12H,3H2,1-2H3,(H,23,24)(H2,20,21,22,26) |
| InChiKey: | InChIKey=MEKJCJOZRBFCMJ-UHFFFAOYSA-N |
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