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| Standard English name | |
|---|---|
| Cas No. | 871914-24-8 |
| Alias | (2S,3S,4R,5R)-5-(2-chloro-6-((3-iodobenzyl)amino)-9H-purin-9-yl)-N-(3,3-diphenylpropyl)-3,4-dihydroxytetrahydrothiophene-2-carboxamide |
| Canonical Smiles | O[C@@H]1[C@H](S[C@H]([C@@H]1O)N1C=NC2=C(NCC3C=C(I)C=CC=3)N=C(Cl)N=C12)C(=O)NCCC(C1C=CC=CC=1)C1C=CC=CC=1 |
| MDL No. | |
| Exact Mass | 740.08333 |
| Smiles | O[C@H]1[C@H](N2C=NC3=C(NCC4=CC=CC(I)=C4)N=C(Cl)N=C23)S[C@H](C(NCCC(C5=CC=CC=C5)C6=CC=CC=C6)=O)[C@H]1O |
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| Inchi | InChI=1S/C32H30ClIN6O3S/c33-32-38-28(36-17-19-8-7-13-22(34)16-19)24-29(39-32)40(18-37-24)31-26(42)25(41)27(44-31)30(43)35-15-14-23(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-13,16,18,23,25-27,31,41-42H,14-15,17H2,(H,35,43)(H,36,38,39)/t25-,26+,27-,31+/m0/s1 |
| InchiKey | ZGJUUFIDIPBQSA-OVDFTCDZSA-N |
| Remark |
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