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CHEBI:64218 - (2S,3S)-nemonapride
| Formula | C21H26ClN3O2 |
| Net Charge | 0 |
| Average Mass | 387.911 |
| Monoisotopic Mass | 387.17135 |
| SMILES | CNc1cc(OC)c(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1Cl |
| InChI | InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)/t14-,18-/m0/s1 |
| InChIKey | KRVOJOCLBAAKSJ-KSSFIOAISA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S,3S)-nemonapride (CHEBI:64218) is a N-(1-benzyl-2-methylpyrrolidin-3-yl)-5-chloro-2-methoxy-4-(methylamino)benzamide (CHEBI:64217) |
| (2S,3S)-nemonapride (CHEBI:64218) is enantiomer of (2R,3R)-nemonapride (CHEBI:64219) |
| Incoming Relation(s) |
| nemonapride (CHEBI:31899) has part (2S,3S)-nemonapride (CHEBI:64218) |
| (2R,3R)-nemonapride (CHEBI:64219) is enantiomer of (2S,3S)-nemonapride (CHEBI:64218) |
| IUPAC Name |
|---|
| N-[(2S,3S)-1-benzyl-2-methylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(methylamino)benzamide |
| Synonyms | Source |
|---|---|
| (−)-nemonapride | ChEBI |
| (2S,3S)-emonapride | ChEBI |
| (2S-cis)-5-chloro-2-methoxy-4-(methylamino)-N-[2-methyl-1-(phenylmethyl)-3-pyrrolidinyl]benzamide | ChEBI |
| 5-chloro-2-methoxy-4-(methylamino)-N-[(2S,3S)-2-methyl-1-(phenylmethyl)-3-pyrrolidinyl]benzamide | ChEBI |