[[1-(2-CHLOROBENZYL)-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL]THIO]ACETIC ACID

pro_cas
956568-51-7
pro_cdbregno
CCD00645744
pro_formula
C14 H13 Cl N2 O3 S
pro_molWeight
324.787

basic_info

Product_Name: [[1-(2-CHLOROBENZYL)-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL]THIO]ACETIC ACID
CAS: 956568-51-7
EnglishSynonyms: [[1-(2-CHLOROBENZYL)-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL]THIO]ACETIC ACID ; 2-((1-[(2-CHLOROPHENYL)METHYL]-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL)SULFANYL)ACETIC ACID ; ((2-[(2-CHLOROPHENYL)METHYL]-4-FORMYL-5-METHYLPYRAZOL-3-YL)SULFANYL)ACETIC ACID
pro_mdlNumber: MFCD08444389
pro_acceptors: 5
pro_donors: 1
pro_smile: Cc1c(c(n(n1)Cc2ccccc2Cl)SCC(=O)O)C=O
InChi: InChI=1S/C14H13ClN2O3S/c1-9-11(7-18)14(21-8-13(19)20)17(16-9)6-10-4-2-3-5-12(10)15/h2-5,7H,6,8H2,1H3,(H,19,20)
InChiKey: InChIKey=AZFBXTZFBLIYCH-UHFFFAOYSA-N

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