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

Systemtic Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] but-3-enoate Openeye Name: [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] but-3-enoate CAS Name: 3-butenoic acid [4-[2-(4-hexylphenyl)-5-thiazolyl]phenyl] ester IUPAC Name: [4-[2-(4-hexylphenyl)-1,3-thiazol-5-yl]phenyl] but-3-enoate Traditional Name: but-3-enoic acid [4-[2-(4-hexylphenyl)thiazol-5-yl]phenyl] ester Formula: C25H27NO2S MolecularWeight: 405.55238

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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)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C25H27NO2S/c1-3-5-6-7-9-19-10-12-21(13-11-19)25-26-18-23(29-25)20-14-16-22(17-15-20)28-24(27)8-4-2/h4,10-18H,2-3,5-9H2,1H3