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CHEBI:47162 - N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide
| Formula | C22H27ClN6O4S |
| Net Charge | 0 |
| Average Mass | 507.016 |
| Monoisotopic Mass | 506.15030 |
| SMILES | [H]/N=C(\N([H])[H])N([H])C([H])([H])C([H])([H])C([H])([H])[C@@]([H])(C(=O)c1nc([H])c([H])s1)N([H])C(=O)[C@@]([H])(N([H])C(=O)C(=O)c1c([H])c([H])c([H])c(Cl)c1[H])C([H])(C([H])([H])[H])C([H])([H])[H] |
| InChI | InChI=1S/C22H27ClN6O4S/c1-12(2)16(29-20(33)17(30)13-5-3-6-14(23)11-13)19(32)28-15(7-4-8-27-22(24)25)18(31)21-26-9-10-34-21/h3,5-6,9-12,15-16H,4,7-8H2,1-2H3,(H,28,32)(H,29,33)(H4,24,25,27)/t15-,16-/m0/s1 |
| InChIKey | NZMZDRVEUJTADA-HOTGVXAUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide (CHEBI:47162) has functional parent acetamide (CHEBI:27856) |
| N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide (CHEBI:47162) is a 1,3-thiazoles (CHEBI:38418) |
| N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide (CHEBI:47162) is a guanidines (CHEBI:24436) |
| N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide (CHEBI:47162) is a monochlorobenzenes (CHEBI:83403) |
| Synonyms | Source |
|---|---|
| N-[(1S)-1-{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide | PDBeChem |
| 2-[2-(3-CHLORO-PHENYL)-2-HYDROXY-ACETYLAMINO]-N-[4-GUANIDINO-1-(THIAZOLE-2-CARBONYL)-BUTYL]-3-METHYL-BUTYRAMIDE | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 716 | PDBeChem |