trans-3-[5-[(7R,14R)-6-(cyclopropylmethyl)-1-(difluoromethoxy)-5,6,7,14-tetrahydro-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 | |
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| Exact Mass | 600.20967 |
| Smiles | O(C1C=CC=C2C=1[C@@]1([H])C[C@@]([H])(N(C2=O)CC2CC2)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)C1=CC=C2N=C3[C@H]4C[C@H](C5C(=CC=CC=5OC(F)F)C(=O)N4CC4CC4)N3C2=C1)CF |
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| Inchi | InChI=1S/C32H27F3N6O3/c33-15-31(16-36)13-32(43,14-31)29-37-10-19(11-38-29)18-6-7-21-22(8-18)41-23-9-24(27(41)39-21)40(12-17-4-5-17)28(42)20-2-1-3-25(26(20)23)44-30(34)35/h1-3,6-8,10-11,17,23-24,30,43H,4-5,9,12-15H2/t23-,24-,31-,32+/m1/s1 |
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| InchiKey | COJIBZUNQCRFQQ-RTZFHNOTSA-N |
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