(1R,3r)-3-(5-((7R,14R)-1-(difluoromethoxy)-6-(((1r,3R)-3-methoxycyclobutyl)methyl)-5-oxo-5,6,7,14-tetrahydro-7,14-methanobenzo[f]benzo[4,5]imidazo[1,2-a][1,4]diazocin-11-yl)pyrimidin-2-yl)-1-(fluoromethyl)-3-hydroxycyclobutanecarbonitrile
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Basic information
| GHS | |
|---|---|
| Exact Mass | 644.23589 |
| Smiles | O(C1C=CC=C2C=1[C@@]1([H])C[C@@]([H])(N(C2=O)C[C@@H]2C[C@@H](OC)C2)C2=NC3C(=CC(C4C=NC([C@]5(C[C@@](C#N)(CF)C5)O)=NC=4)=CC=3)N12)C(F)F |
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| Canonical Smiles | CO[C@@H]1C[C@@H](CN2[C@@H]3C[C@H](C4=C(C=CC=C4C2=O)OC(F)F)N2C3=NC3=CC=C(C=C23)C2=CN=C(N=C2)[C@]2(O)C[C@](CF)(C2)C#N)C1 |
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| Inchi | InChI=1S/C34H31F3N6O4/c1-46-21-7-18(8-21)13-42-26-10-25(28-22(30(42)44)3-2-4-27(28)47-32(36)37)43-24-9-19(5-6-23(24)41-29(26)43)20-11-39-31(40-12-20)34(45)14-33(15-34,16-35)17-38/h2-6,9,11-12,18,21,25-26,32,45H,7-8,10,13-16H2,1H3/t18-,21-,25-,26-,33-,34+/m1/s1 |
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| InchiKey | CESNEGHNSRLTCG-JFPFAIKPSA-N |
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