N-((1s,3S)-1-(5-((7R,14R)-1-(difluoromethoxy)-6-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)-3-(fluoromethyl)cyclobutyl)-2-methylpropane-2-sulfinamide
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Basic information
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Exact Mass | 638.22869 |
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@H](CF)C5)NS(=O)C(C)(C)C)=NC=4)=CC=3)N12)C(F)F |
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Canonical Smiles | CC(C)(C)S(=O)N[C@]1(C[C@H](C1)CF)C1N=CC(=CN=1)C1C=C2C(=CC=1)N=C1[C@H]3C[C@H](C4C(=CC=CC=4OC(F)F)C(=O)N3C)N21 |
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Inchi | InChI=1S/C32H33F3N6O3S/c1-31(2,3)45(43)39-32(12-17(13-32)14-33)29-36-15-19(16-37-29)18-8-9-21-22(10-18)41-23-11-24(27(41)38-21)40(4)28(42)20-6-5-7-25(26(20)23)44-30(34)35/h5-10,15-17,23-24,30,39H,11-14H2,1-4H3/t17-,23-,24-,32+,45?/m1/s1 |
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InchiKey | NSRNLNYUKZLLKX-CZSHWEIFSA-N |
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