(2Z)-3-ethyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-ol

Systemtic Name: (2Z)-3-ethyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-ol Openeye Name: (2Z)-3-ethyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylene]-1,3-benzothiazol-5-ol CAS Name: (2Z)-3-ethyl-2-[(1-ethyl-7-methyl-2-quinolin-1-iumyl)methylidene]-1,3-benzothiazol-5-ol IUPAC Name: (2Z)-3-ethyl-2-[(1-ethyl-7-methylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-ol Traditional Name: (2Z)-3-ethyl-2-[(1-ethyl-7-methyl-quinolin-1-ium-2-yl)methylene]-1,3-benzothiazol-5-ol Formula: C22H23N2OS+ MolecularWeight: 363.49582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)O)SC1=CC3=[N+](C4=C(C=CC(=C4)C)C=C3)CC

Isomeric SMILES

CCN\1C2=C(C=CC(=C2)O)S/C1=C\C3=[N+](C4=C(C=CC(=C4)C)C=C3)CC

InChI

InChI=1S/C22H22N2OS/c1-4-23-17(9-8-16-7-6-15(3)12-19(16)23)13-22-24(5-2)20-14-18(25)10-11-21(20)26-22/h6-14H,4-5H2,1-3H3/p+1