2-(3-fluoranyl-4-hexoxy-phenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(3-fluoranyl-4-hexoxy-phenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole Openeye Name: 2-(3-fluoro-4-hexoxy-phenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole CAS Name: 2-(3-fluoro-4-hexoxyphenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole IUPAC Name: 2-(3-fluoro-4-hexoxyphenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole Traditional Name: 2-(3-fluoro-4-hexoxy-phenyl)-5-(4-hexylphenyl)-1,3,4-thiadiazole Formula: C26H33FN2OS MolecularWeight: 440.616423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC(=C(C=C3)OCCCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC(=C(C=C3)OCCCCCC)F

InChI

InChI=1S/C26H33FN2OS/c1-3-5-7-9-11-20-12-14-21(15-13-20)25-28-29-26(31-25)22-16-17-24(23(27)19-22)30-18-10-8-6-4-2/h12-17,19H,3-11,18H2,1-2H3