(2Z)-3-ethyl-2-[(1-propylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole

Systemtic Name: (2Z)-3-ethyl-2-[(1-propylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole Openeye Name: (2Z)-3-ethyl-2-[(1-propylquinolin-1-ium-2-yl)methylene]-1,3-benzothiazole CAS Name: (2Z)-3-ethyl-2-[(1-propyl-2-quinolin-1-iumyl)methylidene]-1,3-benzothiazole IUPAC Name: (2Z)-3-ethyl-2-[(1-propylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazole Traditional Name: (2Z)-3-ethyl-2-[(1-propylquinolin-1-ium-2-yl)methylene]-1,3-benzothiazole Formula: C22H23N2S+ MolecularWeight: 347.49642

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC

Isomeric SMILES

CCC[N+]1=C(C=CC2=CC=CC=C21)/C=C\3/N(C4=CC=CC=C4S3)CC

InChI

InChI=1S/C22H23N2S/c1-3-15-24-18(14-13-17-9-5-6-10-19(17)24)16-22-23(4-2)20-11-7-8-12-21(20)25-22/h5-14,16H,3-4,15H2,1-2H3/q+1