N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxy-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-yl]ethanamide iodide

Systemtic Name: N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxy-quinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-yl]ethanamide iodide Openeye Name: N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxy-quinolin-1-ium-2-yl)methylene]-1,3-benzothiazol-5-yl]acetamide iodide CAS Name: N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxy-2-quinolin-1-iumyl)methylidene]-1,3-benzothiazol-5-yl]acetamide iodide IUPAC Name: N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-5-yl]acetamide iodide Traditional Name: N-[(2Z)-3-ethyl-2-[(1-ethyl-6-methoxy-quinolin-1-ium-2-yl)methylene]-1,3-benzothiazol-5-yl]acetamide iodide Formula: C24H26IN3O2S MolecularWeight: 547.45161

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)NC(=O)C)SC1=CC3=[N+](C4=C(C=C3)C=C(C=C4)OC)CC.[I-]

Isomeric SMILES

CCN\1C2=C(C=CC(=C2)NC(=O)C)S/C1=C\C3=[N+](C4=C(C=C3)C=C(C=C4)OC)CC.[I-]

InChI

InChI=1S/C24H25N3O2S.HI/c1-5-26-19(9-7-17-13-20(29-4)10-11-21(17)26)15-24-27(6-2)22-14-18(25-16(3)28)8-12-23(22)30-24;/h7-15H,5-6H2,1-4H3;1H