(2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3,6-dimethyl-1,3-benzothiazole

Systemtic Name: (2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3,6-dimethyl-1,3-benzothiazole Openeye Name: (2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylene]-3,6-dimethyl-1,3-benzothiazole CAS Name: (2Z)-2-[(1-ethyl-2-quinolin-1-iumyl)methylidene]-3,6-dimethyl-1,3-benzothiazole IUPAC Name: (2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-3,6-dimethyl-1,3-benzothiazole Traditional Name: (2Z)-2-[(1-ethylquinolin-1-ium-2-yl)methylene]-3,6-dimethyl-1,3-benzothiazole Formula: C21H21N2S+ MolecularWeight: 333.46984

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=C(S3)C=C(C=C4)C)C

Isomeric SMILES

CC[N+]1=C(C=CC2=CC=CC=C21)/C=C\3/N(C4=C(S3)C=C(C=C4)C)C

InChI

InChI=1S/C21H21N2S/c1-4-23-17(11-10-16-7-5-6-8-18(16)23)14-21-22(3)19-12-9-15(2)13-20(19)24-21/h5-14H,4H2,1-3H3/q+1