6,7-bis(fluoranyl)-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole

Systemtic Name: 6,7-bis(fluoranyl)-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Openeye Name: 6,7-difluoro-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole CAS Name: 6,7-difluoro-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole IUPAC Name: 6,7-difluoro-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Traditional Name: 6,7-difluoro-5-hexyl-2-(4-hexylphenyl)-1,3-benzothiazole Formula: C25H31F2NS MolecularWeight: 415.582146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31F2NS/c1-3-5-7-9-11-18-13-15-19(16-14-18)25-28-21-17-20(12-10-8-6-4-2)22(26)23(27)24(21)29-25/h13-17H,3-12H2,1-2H3