[(4-ALLYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-ACETIC ACID

pro_cas
18204-57-4
pro_cdbregno
CCD00129194
pro_formula
C13 H13 N3 O2 S
pro_molWeight
275.331

basic_info

Product_Name: [(4-ALLYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-ACETIC ACID
CAS: 18204-57-4
EnglishSynonyms: (4-ALLYL-5-PHENYL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID ; [(4-ALLYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO]-ACETIC ACID ; 2-(4-ALLYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YLSULFANYL)ACETIC ACID
pro_mdlNumber: MFCD00430301
pro_acceptors: 5
pro_donors: 1
pro_smile: C=CCn1c(nnc1SCC(=O)O)c2ccccc2
InChi: InChI=1S/C13H13N3O2S/c1-2-8-16-12(10-6-4-3-5-7-10)14-15-13(16)19-9-11(17)18/h2-7H,1,8-9H2,(H,17,18)
InChiKey: InChIKey=GZZCGBONHJILEF-UHFFFAOYSA-N

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