[2-fluoranyl-4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] heptanoate

Systemtic Name: [2-fluoranyl-4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] heptanoate Openeye Name: [2-fluoro-4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] heptanoate CAS Name: heptanoic acid [2-fluoro-4-[2-(4-hexylphenyl)-5-thiazolyl]phenyl] ester IUPAC Name: [2-fluoro-4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] heptanoate Traditional Name: enanthic acid [2-fluoro-4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] ester Formula: C28H34FNO2S MolecularWeight: 467.638463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34FNO2S/c1-3-5-7-9-11-21-13-15-22(16-14-21)28-30-20-26(33-28)23-17-18-25(24(29)19-23)32-27(31)12-10-8-6-4-2/h13-20H,3-12H2,1-2H3