2-([(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]THIO)NICOTINIC ACID

pro_cas
851903-45-2
pro_cdbregno
CCD00549121
pro_formula
C12 H12 N2 O3 S
pro_molWeight
264.304

basic_info

Product_Name: 2-([(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]THIO)NICOTINIC ACID
CAS: 851903-45-2
EnglishSynonyms: 2-([(DIMETHYL-1,2-OXAZOL-4-YL)METHYL]SULFANYL)PYRIDINE-3-CARBOXYLIC ACID ; 2-([(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]THIO)NICOTINIC ACID
pro_mdlNumber: MFCD06655262
pro_acceptors: 5
pro_donors: 1
pro_smile: Cc1c(c(on1)C)CSc2c(cccn2)C(=O)O
InChi: InChI=1S/C12H12N2O3S/c1-7-10(8(2)17-14-7)6-18-11-9(12(15)16)4-3-5-13-11/h3-5H,6H2,1-2H3,(H,15,16)
InChiKey: InChIKey=NGIXNFYAERHBRC-UHFFFAOYSA-N

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