3-methyl-2-(2-methylquinolin-8-yl)-1,3-benzothiazol-3-ium

Systemtic Name: 3-methyl-2-(2-methylquinolin-8-yl)-1,3-benzothiazol-3-ium Openeye Name: 3-methyl-2-(2-methyl-8-quinolyl)-1,3-benzothiazol-3-ium CAS Name: 3-methyl-2-(2-methyl-8-quinolinyl)-1,3-benzothiazol-3-ium IUPAC Name: 3-methyl-2-(2-methylquinolin-8-yl)-1,3-benzothiazol-3-ium Traditional Name: 3-methyl-2-(2-methyl-8-quinolyl)-1,3-benzothiazol-3-ium Formula: C18H15N2S+ MolecularWeight: 291.3901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C3=[N+](C4=CC=CC=C4S3)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2C3=[N+](C4=CC=CC=C4S3)C)C=C1

InChI

InChI=1S/C18H15N2S/c1-12-10-11-13-6-5-7-14(17(13)19-12)18-20(2)15-8-3-4-9-16(15)21-18/h3-11H,1-2H3/q+1