basic_info |
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| Product_Name: | ([3-CYANO-5-[(DIMETHYLAMINO)CARBONYL]-4-(2-FURYL)-6-METHYLPYRIDIN-2-YL]THIO)ACETIC ACID |
| CAS: | 851398-36-2 |
| EnglishSynonyms: | 2-([3-CYANO-5-(DIMETHYLCARBAMOYL)-4-(FURAN-2-YL)-6-METHYLPYRIDIN-2-YL]SULFANYL)ACETIC ACID ; ([3-CYANO-5-[(DIMETHYLAMINO)CARBONYL]-4-(2-FURYL)-6-METHYLPYRIDIN-2-YL]THIO)ACETIC ACID ; ([3-CYANO-5-(DIMETHYLCARBAMOYL)-4-(FURAN-2-YL)-6-METHYLPYRIDIN-2-YL]SULFANYL)ACETIC ACID |
| pro_mdlNumber: | MFCD06380322 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | Cc1c(c(c(c(n1)SCC(=O)O)C#N)c2ccco2)C(=O)N(C)C |
| InChi: | InChI=1S/C16H15N3O4S/c1-9-13(16(22)19(2)3)14(11-5-4-6-23-11)10(7-17)15(18-9)24-8-12(20)21/h4-6H,8H2,1-3H3,(H,20,21) |
| InChiKey: | InChIKey=NUBYKENDTGVHPV-UHFFFAOYSA-N |
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