2-CHLORO-5-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

pro_cas
536978-16-2
pro_cdbregno
CCD00397159
pro_formula
C22 H17 Cl N2 O4 S
pro_molWeight
440.905

basic_info

Product_Name: 2-CHLORO-5-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 536978-16-2
EnglishSynonyms: 2-CHLORO-5-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 2-CHLORO-5-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-
pro_mdlNumber: MFCD03573391
pro_acceptors: 6
pro_donors: 3
pro_smile: c1ccc(cc1)OCc2cccc(c2)C(=O)NC(=S)Nc3ccc(c(c3)C(=O)O)Cl
InChi: InChI=1S/C22H17ClN2O4S/c23-19-10-9-16(12-18(19)21(27)28)24-22(30)25-20(26)15-6-4-5-14(11-15)13-29-17-7-2-1-3-8-17/h1-12H,13H2,(H,27,28)(H2,24,25,26,30)
InChiKey: InChIKey=WODRIMAJEAYGJM-UHFFFAOYSA-N

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