N-[(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3-propyl-1,3-benzothiazol-6-yl]ethanamide

Systemtic Name: N-[(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3-propyl-1,3-benzothiazol-6-yl]ethanamide Openeye Name: N-[(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylene]-3-propyl-1,3-benzothiazol-6-yl]acetamide CAS Name: N-[(2Z)-2-[(1-ethyl-2-quinolin-1-iumyl)methylidene]-3-propyl-1,3-benzothiazol-6-yl]acetamide IUPAC Name: N-[(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3-propyl-1,3-benzothiazol-6-yl]acetamide Traditional Name: N-[(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylene]-3-propyl-1,3-benzothiazol-6-yl]acetamide Formula: C24H26N3OS+ MolecularWeight: 404.54774

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)C)SC1=CC3=[N+](C4=CC=CC=C4C=C3)CC

Isomeric SMILES

CCCN\1C2=C(C=C(C=C2)NC(=O)C)S/C1=C\C3=[N+](C4=CC=CC=C4C=C3)CC

InChI

InChI=1S/C24H25N3OS/c1-4-14-27-22-13-11-19(25-17(3)28)15-23(22)29-24(27)16-20-12-10-18-8-6-7-9-21(18)26(20)5-2/h6-13,15-16H,4-5,14H2,1-3H3/p+1