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Basic information
GHS | |
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Exact Mass | 464.14230 |
Smiles | C(N1N=CC(C2C=C(C(=NC=2)[C@H](C)OC)Br)=C1)[C@H]1CCCN1C(=O)OC(C)(C)C |
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Canonical Smiles | C[C@H](OC)C1=NC=C(C=C1Br)C1C=NN(C[C@H]2CCCN2C(=O)OC(C)(C)C)C=1 |
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Physicochemical Propertie | |
Inchi | InChI=1S/C21H29BrN4O3/c1-14(28-5)19-18(22)9-15(10-23-19)16-11-24-25(12-16)13-17-7-6-8-26(17)20(27)29-21(2,3)4/h9-12,14,17H,6-8,13H2,1-5H3/t14-,17+/m0/s1 |
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Useage | |
InchiKey | IJKSYHVWAXZQOU-WMLDXEAASA-N |
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Security information
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