basic_info |
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| Product_Name: | 4-((4-OXO-1,4-DIHYDROPYRIMIDIN-2-YL)AMINO)BENZONITRILE |
| CAS: | 189956-45-4 |
| EnglishSynonyms: | 4-[(4-HYDROXY-2-PYRIMIDINYL)AMINO]BENZONITRILE ; 4-[(1,4-DIHYDRO-4-OXO-2-PYRIMIDINYL)AMINO]BENZONITRILE ; 4-((4-OXO-1,4-DIHYDROPYRIMIDIN-2-YL)AMINO)BENZONITRILE |
| pro_mdlNumber: | MFCD17018923 |
| pro_acceptors: | 5 |
| pro_donors: | 2 |
| pro_smile: | c1cc(ccc1C#N)Nc2[nH]ccc(=O)n2 |
| InChi: | InChI=1S/C11H8N4O/c12-7-8-1-3-9(4-2-8)14-11-13-6-5-10(16)15-11/h1-6H,(H2,13,14,15,16) |
| InChiKey: | InChIKey=BBNOJNASJQRRSH-UHFFFAOYSA-N |
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