5-BROMO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

pro_cas
532432-40-9
pro_cdbregno
CCD00396819
pro_formula
C16 H12 Br N3 O5 S
pro_molWeight
438.257

basic_info

Product_Name: 5-BROMO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 532432-40-9
EnglishSynonyms: BENZOIC ACID, 5-BROMO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- ; 5-BROMO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_mdlNumber: MFCD03570273
pro_acceptors: 8
pro_donors: 3
pro_smile: Cc1cc(ccc1[N+](=O)[O-])C(=O)NC(=S)Nc2ccc(cc2C(=O)O)Br
InChi: InChI=1S/C16H12BrN3O5S/c1-8-6-9(2-5-13(8)20(24)25)14(21)19-16(26)18-12-4-3-10(17)7-11(12)15(22)23/h2-7H,1H3,(H,22,23)(H2,18,19,21,26)
InChiKey: InChIKey=BSHUXROFBAVIHU-UHFFFAOYSA-N

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