basic_info |
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Product_Name: | 2-[(6-CHLORO-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN-4-YL)CARBAMOYL]ACETIC ACID |
EnglishSynonyms: | 2-[(6-CHLORO-3,4-DIHYDRO-2H-1-BENZOTHIOPYRAN-4-YL)CARBAMOYL]ACETIC ACID |
pro_mdlNumber: | MFCD17453013 |
pro_acceptors: | 4 |
pro_donors: | 2 |
pro_smile: | c1cc2c(cc1Cl)C(CCS2)NC(=O)CC(=O)O |
InChi: | InChI=1S/C12H12ClNO3S/c13-7-1-2-10-8(5-7)9(3-4-18-10)14-11(15)6-12(16)17/h1-2,5,9H,3-4,6H2,(H,14,15)(H,16,17) |
InChiKey: | InChIKey=PJUSFCMGWBMRNT-UHFFFAOYSA-N |
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