(2Z)-3-ethyl-2-[(E)-3-[2,3,4,7-tetramethyl-3-(phenylmethyl)isoindol-2-ium-1-yl]prop-2-enylidene]-1,3-benzothiazole

Systemtic Name: (2Z)-3-ethyl-2-[(E)-3-[2,3,4,7-tetramethyl-3-(phenylmethyl)isoindol-2-ium-1-yl]prop-2-enylidene]-1,3-benzothiazole Openeye Name: (2Z)-2-[(E)-3-(3-benzyl-2,3,4,7-tetramethyl-isoindol-2-ium-1-yl)prop-2-enylidene]-3-ethyl-1,3-benzothiazole CAS Name: (2Z)-3-ethyl-2-[(E)-3-[2,3,4,7-tetramethyl-3-(phenylmethyl)-1-isoindol-2-iumyl]prop-2-enylidene]-1,3-benzothiazole IUPAC Name: (2Z)-2-[(E)-3-(3-benzyl-2,3,4,7-tetramethylisoindol-2-ium-1-yl)prop-2-enylidene]-3-ethyl-1,3-benzothiazole Traditional Name: (2Z)-2-[(E)-3-(3-benzyl-2,3,4,7-tetramethyl-isoindol-2-ium-1-yl)prop-2-enylidene]-3-ethyl-1,3-benzothiazole Formula: C31H33N2S+ MolecularWeight: 465.67212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2SC1=CC=CC3=[N+](C(C4=C(C=CC(=C34)C)C)(C)CC5=CC=CC=C5)C

Isomeric SMILES

CCN\1C2=CC=CC=C2S/C1=C\C=C\C3=[N+](C(C4=C(C=CC(=C34)C)C)(C)CC5=CC=CC=C5)C

InChI

InChI=1S/C31H33N2S/c1-6-33-25-15-10-11-17-27(25)34-28(33)18-12-16-26-29-22(2)19-20-23(3)30(29)31(4,32(26)5)21-24-13-8-7-9-14-24/h7-20H,6,21H2,1-5H3/q+1