J0D
1-methyl-4-[(Z)-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]quinolin-1-ium
Find entries where: J0D
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 1-methyl-4-[(Z)-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]quinolin-1-ium |
| Synonyms | Thiazole orange |
| Identifiers | (2~{Z})-3-methyl-2-[(1-methylquinolin-1-ium-4-yl)methylidene]-1,3-benzothiazole |
| Formula | C19 H17 N2 S |
| Molecular Weight | 305.417 |
| Type | NON-POLYMER |
| Isomeric SMILES | C[n+]1ccc(c2c1cccc2)/C=C\3/N(c4ccccc4S3)C |
| InChI | InChI=1S/C19H17N2S/c1-20-12-11-14(15-7-3-4-8-16(15)20)13-19-21(2)17-9-5-6-10-18(17)22-19/h3-13H,1-2H3/q+1 |
| InChIKey | XRXJDLHDDHBJOJ-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 1 |
| Atom Count | 39 |
| Chiral Atom Count | 0 |
| Bond Count | 42 |
| Aromatic Bond Count | 17 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 123859, 1268073, 853679 |
| ChEMBL | CHEMBL4117515 |
| ChEBI | CHEBI:52924 |
| CCDC/CSD | NIVFEG |
