basic_info |
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| Product_Name: | 2-([(3-CYANOPHENYL)METHYL]SULFANYL)ACETIC ACID |
| CAS: | 887090-48-4 |
| EnglishSynonyms: | 2-([(3-CYANOPHENYL)METHYL]SULFANYL)ACETIC ACID ; ([(3-CYANOPHENYL)METHYL]SULFANYL)ACETIC ACID ; [(3-CYANOBENZYL)THIO]ACETIC ACID |
| pro_mdlNumber: | MFCD02755449 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | c1cc(cc(c1)C#N)CSCC(=O)O |
| InChi: | InChI=1S/C10H9NO2S/c11-5-8-2-1-3-9(4-8)6-14-7-10(12)13/h1-4H,6-7H2,(H,12,13) |
| InChiKey: | InChIKey=ZUTJBZUVXGLAJA-UHFFFAOYSA-N |
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