[2-fluoranyl-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] ethanoate

Systemtic Name: [2-fluoranyl-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] ethanoate Openeye Name: [2-fluoro-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] acetate CAS Name: acetic acid [2-fluoro-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] ester IUPAC Name: [2-fluoro-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] acetate Traditional Name: acetic acid [2-fluoro-4-[5-(4-hexylphenyl)-1,3,4-thiadiazol-2-yl]phenyl] ester Formula: C22H23FN2O2S MolecularWeight: 398.493623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23FN2O2S/c1-3-4-5-6-7-16-8-10-17(11-9-16)21-24-25-22(28-21)18-12-13-20(19(23)14-18)27-15(2)26/h8-14H,3-7H2,1-2H3