3,5-DIBROMO-2-[[[(4-ETHOXY-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

pro_cas
532419-51-5
pro_cdbregno
CCD00396765
pro_formula
C17 H13 Br2 N3 O6 S
pro_molWeight
547.179

basic_info

Product_Name: 3,5-DIBROMO-2-[[[(4-ETHOXY-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 532419-51-5
EnglishSynonyms: BENZOIC ACID, 3,5-DIBROMO-2-[[[(4-ETHOXY-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 3,5-DIBROMO-2-[[[(4-ETHOXY-3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_mdlNumber: MFCD03569885
pro_acceptors: 9
pro_donors: 3
pro_smile: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc2c(cc(cc2Br)Br)C(=O)O
InChi: InChI=1S/C17H13Br2N3O6S/c1-2-28-13-4-3-8(5-12(13)22(26)27)15(23)21-17(29)20-14-10(16(24)25)6-9(18)7-11(14)19/h3-7H,2H2,1H3,(H,24,25)(H2,20,21,23,29)
InChiKey: InChIKey=IDHBLOZOXZRVHM-UHFFFAOYSA-N

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