(2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-1,3-benzothiazole

Systemtic Name: (2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-1,3-benzothiazole Openeye Name: (2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methylene]-1,3-benzothiazole CAS Name: (2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methyl-4-pyridin-1-iumyl)methylidene]-1,3-benzothiazole IUPAC Name: (2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methylidene]-1,3-benzothiazole Traditional Name: (2Z)-6-(1,3-benzothiazol-2-yl)-3-methyl-2-[(1-methylpyridin-1-ium-4-yl)methylene]-1,3-benzothiazole Formula: C22H18N3S2+ MolecularWeight: 388.52842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)SC1=CC5=CC=[N+](C=C5)C

Isomeric SMILES

CN\1C2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)S/C1=C\C5=CC=[N+](C=C5)C

InChI

InChI=1S/C22H18N3S2/c1-24-11-9-15(10-12-24)13-21-25(2)18-8-7-16(14-20(18)26-21)22-23-17-5-3-4-6-19(17)27-22/h3-14H,1-2H3/q+1