6-bromanyl-2-(4-dodecoxyphenyl)-1,3-benzothiazole

Systemtic Name: 6-bromanyl-2-(4-dodecoxyphenyl)-1,3-benzothiazole Openeye Name: 6-bromo-2-(4-dodecoxyphenyl)-1,3-benzothiazole CAS Name: 6-bromo-2-(4-dodecoxyphenyl)-1,3-benzothiazole IUPAC Name: 6-bromo-2-(4-dodecoxyphenyl)-1,3-benzothiazole Traditional Name: 6-bromo-2-(4-lauryloxyphenyl)-1,3-benzothiazole Formula: C25H32BrNOS MolecularWeight: 474.49668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C25H32BrNOS/c1-2-3-4-5-6-7-8-9-10-11-18-28-22-15-12-20(13-16-22)25-27-23-17-14-21(26)19-24(23)29-25/h12-17,19H,2-11,18H2,1H3