basic_info |
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| Product_Name: | 4-[[[(PHENYLACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| CAS: | 87998-89-8 |
| EnglishSynonyms: | BENZOIC ACID, 4-[[[(PHENYLACETYL)AMINO]THIOXOMETHYL]AMINO]- ; 4-[[[(PHENYLACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
| pro_mdlNumber: | MFCD03564149 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | c1ccc(cc1)CC(=O)NC(=S)Nc2ccc(cc2)C(=O)O |
| InChi: | InChI=1S/C16H14N2O3S/c19-14(10-11-4-2-1-3-5-11)18-16(22)17-13-8-6-12(7-9-13)15(20)21/h1-9H,10H2,(H,20,21)(H2,17,18,19,22) |
| InChiKey: | InChIKey=CMGJOVPUDVACLE-UHFFFAOYSA-N |
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