3-(6-ETHYL-5-METHYL-2-P-TOLYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID

pro_cas
pro_cdbregno
CCD03192096
pro_formula
C21 H21 N3 O2
pro_molWeight
347.416

basic_info

Product_Name: 3-(6-ETHYL-5-METHYL-2-P-TOLYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID
EnglishSynonyms: 3-(6-ETHYL-5-METHYL-2-P-TOLYL-PYRIMIDIN-4-YLAMINO)-BENZOIC ACID
pro_mdlNumber: MFCD16812004
pro_acceptors: 5
pro_donors: 2
pro_smile: CCc1c(c(nc(n1)c2ccc(cc2)C)Nc3cccc(c3)C(=O)O)C
InChi: InChI=1S/C21H21N3O2/c1-4-18-14(3)19(22-17-7-5-6-16(12-17)21(25)26)24-20(23-18)15-10-8-13(2)9-11-15/h5-12H,4H2,1-3H3,(H,25,26)(H,22,23,24)
InChiKey: InChIKey=MERQQFRHVSANAX-UHFFFAOYSA-N

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