trans-3-[5-[(7R,14R)-1-[(1-fluoro-cyclopropyl)methoxy]-5,6,7,14-tetrahydro-6-methyl-5-oxo-7,14-methanobenzimidazo[1,2-b][2,5]benzodiazocin-11-yl]pyrimidin-2-yl]-1-(fluoromethyl)-3-hydroxy-Cyclobutane-carbonitrile
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Basic information
| GHS | |
|---|---|
| Exact Mass | 582.21909 |
| Smiles | O(C1C=CC=C2C=1[C@@]1([H])C[C@@]([H])(N(C2=O)C)C2=NC3C(=CC(C4C=NC([C@]5(C[C@@](C#N)(CF)C5)O)=NC=4)=CC=3)N12)CC1(CC1)F |
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| Canonical Smiles | CN1[C@@H]2C[C@H](C3=C(C=CC=C3C1=O)OCC1(F)CC1)N1C2=NC2=CC=C(C=C12)C1=CN=C(N=C1)[C@]1(O)C[C@@](C1)(CF)C#N |
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| Inchi | InChI=1S/C32H28F2N6O3/c1-39-24-10-23(26-20(28(39)41)3-2-4-25(26)43-17-31(34)7-8-31)40-22-9-18(5-6-21(22)38-27(24)40)19-11-36-29(37-12-19)32(42)13-30(14-32,15-33)16-35/h2-6,9,11-12,23-24,42H,7-8,10,13-15,17H2,1H3/t23-,24-,30-,32+/m1/s1 |
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| InchiKey | BCIHHNRTAFLBFS-YMMDKHRRSA-N |
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