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Basic information
GHS | |
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Exact Mass | 391.08954 |
Smiles | BrC1C([C@H](C)OC)=NC=C(C2N=CC(CN3C[C@H](O)CC3)=CC=2)C=1 |
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Canonical Smiles | C[C@H](OC)C1=NC=C(C=C1Br)C1=CC=C(CN2C[C@H](O)CC2)C=N1 |
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Physicochemical Propertie | |
Inchi | InChI=1S/C18H22BrN3O2/c1-12(24-2)18-16(19)7-14(9-21-18)17-4-3-13(8-20-17)10-22-6-5-15(23)11-22/h3-4,7-9,12,15,23H,5-6,10-11H2,1-2H3/t12-,15+/m0/s1 |
UN No. | |
Feature | |
Useage | |
InchiKey | WJSILMHFXFYCJP-SWLSCSKDSA-N |
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Security information
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