J8S
(4-benzylpiperidin-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone
Find entries where: J8S
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | (4-benzylpiperidin-1-yl)[2-methoxy-4-(methylsulfanyl)phenyl]methanone |
| Identifiers | (2-methoxy-4-methylsulfanyl-phenyl)-[4-(phenylmethyl)piperidin-1-yl]methanone |
| Formula | C21 H25 N O2 S |
| Molecular Weight | 355.494 |
| Type | NON-POLYMER |
| Isomeric SMILES | COc1cc(ccc1C(=O)N2CCC(CC2)Cc3ccccc3)SC |
| InChI | InChI=1S/C21H25NO2S/c1-24-20-15-18(25-2)8-9-19(20)21(23)22-12-10-17(11-13-22)14-16-6-4-3-5-7-16/h3-9,15,17H,10-14H2,1-2H3 |
| InChIKey | OMGLGPKQUFSRNN-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 50 |
| Chiral Atom Count | 0 |
| Bond Count | 52 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 1126109 |
| ChEMBL | CHEMBL1450144 |
| ChEBI | CHEBI:92098 |
