(2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-6-methyl-1,3-benzothiazole

Systemtic Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-6-methyl-1,3-benzothiazole Openeye Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-6-methyl-1,3-benzothiazole CAS Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-6-methyl-1,3-benzothiazole IUPAC Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methylprop-2-enylidene]-6-methyl-1,3-benzothiazole Traditional Name: (2Z)-3-butyl-2-[(E)-3-(3-butyl-6-methyl-1,3-benzothiazol-3-ium-2-yl)-2-methyl-prop-2-enylidene]-6-methyl-1,3-benzothiazole Formula: C28H35N2S2+ MolecularWeight: 463.7209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C)SC1=CC(=CC3=[N+](C4=C(S3)C=C(C=C4)C)CCCC)C

Isomeric SMILES

CCCCN\1C2=C(C=C(C=C2)C)S/C1=C\C(=C\C3=[N+](C4=C(S3)C=C(C=C4)C)CCCC)\C

InChI

InChI=1S/C28H35N2S2/c1-6-8-14-29-23-12-10-20(3)16-25(23)31-27(29)18-22(5)19-28-30(15-9-7-2)24-13-11-21(4)17-26(24)32-28/h10-13,16-19H,6-9,14-15H2,1-5H3/q+1