2-([1-(3-METHYLBUTYL)-3-(PROPAN-2-YL)-1H-PYRAZOL-5-YL]SULFANYL)ACETIC ACID

pro_cas
pro_cdbregno
CCD03597748
pro_formula
C13 H22 N2 O2 S
pro_molWeight
270.395

basic_info

Product_Name: 2-([1-(3-METHYLBUTYL)-3-(PROPAN-2-YL)-1H-PYRAZOL-5-YL]SULFANYL)ACETIC ACID
EnglishSynonyms: 2-([1-(3-METHYLBUTYL)-3-(PROPAN-2-YL)-1H-PYRAZOL-5-YL]SULFANYL)ACETIC ACID
pro_mdlNumber: MFCD17339631
pro_acceptors: 4
pro_donors: 1
pro_smile: CC(C)CCn1c(cc(n1)C(C)C)SCC(=O)O
InChi: InChI=1S/C13H22N2O2S/c1-9(2)5-6-15-12(18-8-13(16)17)7-11(14-15)10(3)4/h7,9-10H,5-6,8H2,1-4H3,(H,16,17)
InChiKey: InChIKey=VYSAHEAKCIQJBI-UHFFFAOYSA-N

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