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3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium

3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium

Systemtic Name:3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium
Openeye Name:3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium
CAS Name:3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium
IUPAC Name:3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium
Traditional Name:3-[12-(1,3-benzothiazol-3-ium-3-yl)dodecyl]-1,3-benzothiazol-3-ium
Formula: C26H34N2S2+2
MolecularWeight: 438.69156
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+](=CS2)CCCCCCCCCCCC[N+]3=CSC4=CC=CC=C43


Isomeric SMILES

C1=CC=C2C(=C1)[N+](=CS2)CCCCCCCCCCCC[N+]3=CSC4=CC=CC=C43


InChI

InChI=1S/C26H34N2S2/c1(3-5-7-13-19-27-21-29-25-17-11-9-15-23(25)27)2-4-6-8-14-20-28-22-30-26-18-12-10-16-24(26)28/h9-12,15-18,21-22H,1-8,13-14,19-20H2/q+2


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