5-[3-(4-BUTOXY-BENZOYL)-THIOUREIDO]-2-CHLORO-BENZOIC ACID

pro_cas
532939-36-9
pro_cdbregno
CCD00387919
pro_formula
C19 H19 Cl N2 O4 S
pro_molWeight
406.888

basic_info

Product_Name: 5-[3-(4-BUTOXY-BENZOYL)-THIOUREIDO]-2-CHLORO-BENZOIC ACID
CAS: 532939-36-9
EnglishSynonyms: BENZOIC ACID, 5-[[[(4-BUTOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-CHLORO- ; 5-[3-(4-BUTOXY-BENZOYL)-THIOUREIDO]-2-CHLORO-BENZOIC ACID ; ZERENEX E/8015389 ; 5-[[[(4-BUTOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-CHLORO-BENZOIC ACID
pro_mdlNumber: MFCD03453790
pro_acceptors: 6
pro_donors: 3
pro_smile: CCCCOc1ccc(cc1)C(=O)NC(=S)Nc2ccc(c(c2)C(=O)O)Cl
InChi: InChI=1S/C19H19ClN2O4S/c1-2-3-10-26-14-7-4-12(5-8-14)17(23)22-19(27)21-13-6-9-16(20)15(11-13)18(24)25/h4-9,11H,2-3,10H2,1H3,(H,24,25)(H2,21,22,23,27)
InChiKey: InChIKey=BDBOUSQWEIGXKN-UHFFFAOYSA-N

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