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

Systemtic Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] hexanoate Openeye Name: [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] hexanoate CAS Name: hexanoic acid [4-[2-(4-hexylphenyl)-5-thiazolyl]phenyl] ester IUPAC Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] hexanoate Traditional Name: hexanoic acid [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] ester Formula: C27H33NO2S MolecularWeight: 435.62142

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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)CCCCC

Isomeric SMILES

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

InChI

InChI=1S/C27H33NO2S/c1-3-5-7-9-10-21-12-14-23(15-13-21)27-28-20-25(31-27)22-16-18-24(19-17-22)30-26(29)11-8-6-4-2/h12-20H,3-11H2,1-2H3