6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole

Systemtic Name: 6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Openeye Name: 6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole CAS Name: 6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole IUPAC Name: 6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Traditional Name: 6-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Formula: C25H33NS MolecularWeight: 379.60122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)CCCCCC

InChI

InChI=1S/C25H33NS/c1-3-5-7-9-11-20-13-16-22(17-14-20)25-26-23-18-15-21(19-24(23)27-25)12-10-8-6-4-2/h13-19H,3-12H2,1-2H3