EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H22F2N4O5S2 |
| Net Charge | 0 |
| Average Mass | 584.626 |
| Monoisotopic Mass | 584.09997 |
| SMILES | [H]c1c([H])c([H])c(C([H])([H])C2=C=NC([C@@]([H])(N([H])S(=O)(=O)c3c([H])c([H])c([H])c(F)c3[H])C([H])([H])c3c([H])c([H])c([C@]4([H])C([H])([H])C(=O)N([H])S4(=O)=O)c([H])c3[H])=N2)c(F)c1[H] |
| InChI | InChI=1S/C27H22F2N4O5S2/c28-20-5-3-6-22(14-20)39(35,36)32-24(27-30-16-21(31-27)13-19-4-1-2-7-23(19)29)12-17-8-10-18(11-9-17)25-15-26(34)33-40(25,37)38/h1-11,14,24-25,32H,12-13,15H2,(H,33,34)/t24-,25-/m0/s1 |
| InChIKey | VAXRFGMVKHOGJO-DQEYMECFSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-fluoro-N-[(1S)-1-[4-[(2-fluorophenyl)methyl]imidazol-2-yl]-2-[4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]benzenesulfonamide (CHEBI:49669) is a unclassifieds (CHEBI:27189) |
| Synonym | Source |
|---|---|
| 3-fluoro-N-[(1S)-1-[4-[(2-fluorophenyl)methyl]imidazol-2-yl]-2-[4-[(5S)-1,1,3-trioxo-1,2-thiazolidin-5-yl]phenyl]ethyl]benzenesulfonamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| IZ3 | PDBeChem |