(1R,3r)-3-(5-((7R,14R)-1-(difluoromethoxy)-6-((1-(fluoromethyl)cyclopropyl)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
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Exact Mass | 632.21590 |
Smiles | O(C1C=CC=C2C=1[C@@]1([H])C[C@@]([H])(N(C2=O)CC2(CC2)CF)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 | N#C[C@@]1(C[C@](O)(C1)C1=NC=C(C=N1)C1C=C2C(=CC=1)N=C1[C@H]3C[C@H](C4C(=CC=CC=4OC(F)F)C(=O)N3CC3(CC3)CF)N21)CF |
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Inchi | InChI=1S/C33H28F4N6O3/c34-14-31(6-7-31)17-42-24-9-23(26-20(28(42)44)2-1-3-25(26)46-30(36)37)43-22-8-18(4-5-21(22)41-27(24)43)19-10-39-29(40-11-19)33(45)12-32(13-33,15-35)16-38/h1-5,8,10-11,23-24,30,45H,6-7,9,12-15,17H2/t23-,24-,32-,33+/m1/s1 |
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InchiKey | IFZBENUGHLMKHW-FTFNNTNBSA-N |
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