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| Formula | C23H25ClN4O |
| Net Charge | 0 |
| Average Mass | 408.933 |
| Monoisotopic Mass | 408.17169 |
| SMILES | CC(c1ccc(Cl)cc1)N1CCC(n2c(=O)n(CCC#N)c3ccccc32)CC1 |
| InChI | InChI=1S/C23H25ClN4O/c1-17(18-7-9-19(24)10-8-18)26-15-11-20(12-16-26)28-22-6-3-2-5-21(22)27(23(28)29)14-4-13-25/h2-3,5-10,17,20H,4,11-12,14-16H2,1H3 |
| InChIKey | SWWAVNFEFVMDAG-UHFFFAOYSA-N |
| Wikipedia |
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| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Roles: | mu-opioid receptor agonist A compound that exhibits agonist activity at the μ-opioid receptor. opioid analgesic A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood. |
| Applications: | mu-opioid receptor agonist A compound that exhibits agonist activity at the μ-opioid receptor. opioid analgesic A narcotic or opioid substance, synthetic or semisynthetic agent producing profound analgesia, drowsiness, and changes in mood. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cychlorphine (CHEBI:761044) has role opioid analgesic (CHEBI:35482) |
| cychlorphine (CHEBI:761044) has role μ-opioid receptor agonist (CHEBI:55322) |
| cychlorphine (CHEBI:761044) is a benzimidazoles (CHEBI:22715) |
| cychlorphine (CHEBI:761044) is a monochlorobenzenes (CHEBI:83403) |
| cychlorphine (CHEBI:761044) is a nitrile (CHEBI:18379) |
| cychlorphine (CHEBI:761044) is a piperidines (CHEBI:26151) |
| cychlorphine (CHEBI:761044) is a tertiary amino compound (CHEBI:50996) |
| cychlorphine (CHEBI:761044) is conjugate base of cychlorphine(1+) (CHEBI:761052) |
| Incoming Relation(s) |
| (R)-cychlorphine (CHEBI:761045) is a cychlorphine (CHEBI:761044) |
| (S)-cychlorphine (CHEBI:761046) is a cychlorphine (CHEBI:761044) |
| cychlorphine(1+) (CHEBI:761052) is conjugate acid of cychlorphine (CHEBI:761044) |
| IUPAC Name |
|---|
| 3-(3-{1-[1-(4-chlorophenyl)ethyl]piperidin-4-yl}-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)propanenitrile |
| Synonyms | Source |
|---|---|
| 3-(3-{1-[1-(4-chlorophenyl)ethyl]piperidin-4-yl}-2-oxo-2,3-dihydro-1H-1,3-benzimidazol-1-yl)propanenitrile | IUPAC |
| 3-(3-(1-(1-(4-chlorophenyl)ethyl)piperidin-4-yl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)propanenitrile | ChEBI |
| cychlorphine (free base) | ChEBI |
| N-propionitrile chlorphine | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| 174605 | ChemSpider |
| Cychlorphine | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| CAS:6449-60-1 | CompTox |
| Citations |
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