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CHEBI:43834 - 4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino}-3-nitrophenyl)sulfonyl]benzamide
| Formula | C36H40N4O6S2 |
| Net Charge | 0 |
| Average Mass | 688.872 |
| Monoisotopic Mass | 688.23893 |
| SMILES | [H]c1c([H])c([H])c(SC([H])([H])C(N([H])c2c([H])c([H])c(S(=O)(=O)N([H])C(=O)c3c([H])c([H])c(N4C([H])([H])C([H])([H])C(OC([H])([H])[H])(C([H])([H])c5c([H])c([H])c([H])c([H])c5[H])C([H])([H])C4([H])[H])c([H])c3[H])c([H])c2[N+](=O)[O-])(C([H])([H])[H])C([H])([H])[H])c([H])c1[H] |
| InChI | InChI=1S/C36H40N4O6S2/c1-35(2,26-47-30-12-8-5-9-13-30)37-32-19-18-31(24-33(32)40(42)43)48(44,45)38-34(41)28-14-16-29(17-15-28)39-22-20-36(46-3,21-23-39)25-27-10-6-4-7-11-27/h4-19,24,37H,20-23,25-26H2,1-3H3,(H,38,41) |
| InChIKey | REQAXYXBBHHBCA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino}-3-nitrophenyl)sulfonyl]benzamide (CHEBI:43834) is a C-nitro compound (CHEBI:35716) |
| 4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino}-3-nitrophenyl)sulfonyl]benzamide (CHEBI:43834) is a benzamides (CHEBI:22702) |
| 4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino}-3-nitrophenyl)sulfonyl]benzamide (CHEBI:43834) is a piperidines (CHEBI:26151) |
| Synonyms | Source |
|---|---|
| 4-(4-BENZYL-4-METHOXYPIPERIDIN-1-YL)-N-[(4-{[1,1-DIMETHYL-2-(PHENYLTHIO)ETHYL]AMINO}-3-NITROPHENYL)SULFONYL]BENZAMIDE | PDBeChem |
| 4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino}-3-nitrophenyl)sulfonyl]benzamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| LI0 | PDBeChem |