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

CAS No.
530134-73-7
CCD No.
CCD00396102
Formula
C22 H18 N2 O4 S
MolWeight
406.46

Basic Information

Product Name: 2-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 530134-73-7
English Synonyms: 2-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 2-[[[[3-(PHENOXYMETHYL)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-
MDL Number.: MFCD03564189
H bond acceptor: 6
H bond donor: 3
Smile: c1ccc(cc1)OCc2cccc(c2)C(=O)NC(=S)Nc3ccccc3C(=O)O
InChi: InChI=1S/C22H18N2O4S/c25-20(24-22(29)23-19-12-5-4-11-18(19)21(26)27)16-8-6-7-15(13-16)14-28-17-9-2-1-3-10-17/h1-13H,14H2,(H,26,27)(H2,23,24,25,29)
InChiKey: InChIKey=MXQLETOOROZVRZ-UHFFFAOYSA-N

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