(2Z)-2-[[1-(4-ethoxyphenyl)-2,6-dimethyl-pyridin-1-ium-4-yl]methylidene]-3-ethyl-1,3-benzothiazole

Systemtic Name: (2Z)-2-[[1-(4-ethoxyphenyl)-2,6-dimethyl-pyridin-1-ium-4-yl]methylidene]-3-ethyl-1,3-benzothiazole Openeye Name: (2Z)-2-[[1-(4-ethoxyphenyl)-2,6-dimethyl-pyridin-1-ium-4-yl]methylene]-3-ethyl-1,3-benzothiazole CAS Name: (2Z)-2-[[1-(4-ethoxyphenyl)-2,6-dimethyl-4-pyridin-1-iumyl]methylidene]-3-ethyl-1,3-benzothiazole IUPAC Name: (2Z)-2-[[1-(4-ethoxyphenyl)-2,6-dimethylpyridin-1-ium-4-yl]methylidene]-3-ethyl-1,3-benzothiazole Traditional Name: (2Z)-2-[(2,6-dimethyl-1-p-phenetyl-pyridin-1-ium-4-yl)methylene]-3-ethyl-1,3-benzothiazole Formula: C25H27N2OS+ MolecularWeight: 403.55968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC3=CC(=[N+](C(=C3)C)C4=CC=C(C=C4)OCC)C

Isomeric SMILES

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

InChI

InChI=1S/C25H27N2OS/c1-5-26-23-9-7-8-10-24(23)29-25(26)17-20-15-18(3)27(19(4)16-20)21-11-13-22(14-12-21)28-6-2/h7-17H,5-6H2,1-4H3/q+1