VITAS-BB TBB021259

CAS No.
CCD No.
CCD00271287
Formula
C22H28BrN3O3
MolWeight
462.385

Basic Information

Product Name: VITAS-BB TBB021259
English Synonyms: VITAS-BB TBB021259
MDL Number.: MFCD01922726
H bond acceptor: 6
H bond donor: 2
Smile: CCCCCCCCC(=O)N\N=C(\C)C1=CC=CC(NC(=O)C2=CC=C(Br)O2)=C1
InChi: InChI=1S/C22H28BrN3O3/c1-3-4-5-6-7-8-12-21(27)26-25-16(2)17-10-9-11-18(15-17)24-22(28)19-13-14-20(23)29-19/h9-11,13-15H,3-8,12H2,1-2H3,(H,24,28)(H,26,27)/b25-16-
InChiKey: InChIKey=UPKUEBVUSKSWBK-XYGWBWBKSA-N

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