(2Z)-3-methyl-2-[(1-prop-2-enylquinolin-1-ium-4-yl)methylidene]-1,3-benzothiazole

Systemtic Name: (2Z)-3-methyl-2-[(1-prop-2-enylquinolin-1-ium-4-yl)methylidene]-1,3-benzothiazole Openeye Name: (2Z)-2-[(1-allylquinolin-1-ium-4-yl)methylene]-3-methyl-1,3-benzothiazole CAS Name: (2Z)-3-methyl-2-[(1-prop-2-enyl-4-quinolin-1-iumyl)methylidene]-1,3-benzothiazole IUPAC Name: (2Z)-3-methyl-2-[(1-prop-2-enylquinolin-1-ium-4-yl)methylidene]-1,3-benzothiazole Traditional Name: (2Z)-2-[(1-allylquinolin-1-ium-4-yl)methylene]-3-methyl-1,3-benzothiazole Formula: C21H19N2S+ MolecularWeight: 331.45396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=CC3=CC=[N+](C4=CC=CC=C34)CC=C

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C\C3=CC=[N+](C4=CC=CC=C34)CC=C

InChI

InChI=1S/C21H19N2S/c1-3-13-23-14-12-16(17-8-4-5-9-18(17)23)15-21-22(2)19-10-6-7-11-20(19)24-21/h3-12,14-15H,1,13H2,2H3/q+1