Molecular Structure:
CCD No.:CCD00128434
VITAS-BB TBB017992
Formula:C14H11BrN2O2S
MolWeight:351.223
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| Product Name： | VITAS-BB TBB017992 |
| English Synonyms： | VITAS-BB TBB017992 |
| MDL Number.： | MFCD00420507 |
| H bond acceptor： | 4 |
| H bond donor： | 1 |
| Smile： | BrC1=CC=C(O1)C(=O)NC1=C(C#N)C2=C(CCCC2)S1 |
| InChi： | InChI=1S/C14H11BrN2O2S/c15-12-6-5-10(19-12)13(18)17-14-9(7-16)8-3-1-2-4-11(8)20-14/h5-6H,1-4H2,(H,17,18) |
| InChiKey： | InChIKey=ODBXUBSKIIGWJL-UHFFFAOYSA-N |
Basic Information
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