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

CAS No.
956568-51-7
CCD No.
CCD00645744
Formula
C14 H13 Cl N2 O3 S
MolWeight
324.787

Basic Information

Product Name: [[1-(2-CHLOROBENZYL)-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL]THIO]ACETIC ACID
CAS: 956568-51-7
English Synonyms: 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 ; [[1-(2-CHLOROBENZYL)-4-FORMYL-3-METHYL-1H-PYRAZOL-5-YL]THIO]ACETIC ACID
MDL Number.: MFCD08444389
H bond acceptor: 5
H bond donor: 1
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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