2-[[[[[4-(1,1-DIMETHYLETHYL)PHENOXY]ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

pro_cas
536977-79-4
pro_cdbregno
CCD00397156
pro_formula
C20 H22 N2 O4 S
pro_molWeight
386.47

basic_info

Product_Name: 2-[[[[[4-(1,1-DIMETHYLETHYL)PHENOXY]ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 536977-79-4
EnglishSynonyms: BENZOIC ACID, 2-[[[[[4-(1,1-DIMETHYLETHYL)PHENOXY]ACETYL]AMINO]THIOXOMETHYL]AMINO]- ; 2-[[[[[4-(1,1-DIMETHYLETHYL)PHENOXY]ACETYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
pro_mdlNumber: MFCD03573357
pro_acceptors: 6
pro_donors: 3
pro_smile: CC(C)(C)c1ccc(cc1)OCC(=O)NC(=S)Nc2ccccc2C(=O)O
InChi: InChI=1S/C20H22N2O4S/c1-20(2,3)13-8-10-14(11-9-13)26-12-17(23)22-19(27)21-16-7-5-4-6-15(16)18(24)25/h4-11H,12H2,1-3H3,(H,24,25)(H2,21,22,23,27)
InChiKey: InChIKey=SEHNOVPUFVWLFX-UHFFFAOYSA-N

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