4-(2,2-DIMETHYL-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL)-4-OXOBUTANOIC ACID

pro_cas
pro_cdbregno
CCD03262838
pro_formula
C14 H17 N O3 S
pro_molWeight
279.358

basic_info

Product_Name: 4-(2,2-DIMETHYL-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL)-4-OXOBUTANOIC ACID
EnglishSynonyms: 4-(2,2-DIMETHYL-2,3-DIHYDRO-4H-1,4-BENZOTHIAZIN-4-YL)-4-OXOBUTANOIC ACID
pro_mdlNumber: MFCD16991125
pro_acceptors: 4
pro_donors: 1
pro_smile: CC1(CN(c2ccccc2S1)C(=O)CCC(=O)O)C
InChi: InChI=1S/C14H17NO3S/c1-14(2)9-15(12(16)7-8-13(17)18)10-5-3-4-6-11(10)19-14/h3-6H,7-9H2,1-2H3,(H,17,18)
InChiKey: InChIKey=KMDIAEBDIRLMIF-UHFFFAOYSA-N

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