basic_info |
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| Product_Name: | 2-[2-(METHYLSULFANYL)ETHYL]-3-OXO-1,2,3,4-TETRAHYDROQUINOXALINE-6-CARBOXYLIC ACID |
| EnglishSynonyms: | 2-[2-(METHYLSULFANYL)ETHYL]-3-OXO-1,2,3,4-TETRAHYDROQUINOXALINE-6-CARBOXYLIC ACID |
| pro_mdlNumber: | MFCD11540128 |
| pro_acceptors: | 5 |
| pro_donors: | 3 |
| pro_smile: | CSCCC1C(=O)Nc2cc(ccc2N1)C(=O)O |
| InChi: | InChI=1S/C12H14N2O3S/c1-18-5-4-9-11(15)14-10-6-7(12(16)17)2-3-8(10)13-9/h2-3,6,9,13H,4-5H2,1H3,(H,14,15)(H,16,17) |
| InChiKey: | InChIKey=QHKREBHYLBXWMJ-UHFFFAOYSA-N |
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