3-(5-butylthiophen-2-yl)-5-(4-octylphenyl)-1,2-oxazole

Systemtic Name: 3-(5-butylthiophen-2-yl)-5-(4-octylphenyl)-1,2-oxazole Openeye Name: 3-(5-butyl-2-thienyl)-5-(4-octylphenyl)isoxazole CAS Name: 3-(5-butyl-2-thiophenyl)-5-(4-octylphenyl)isoxazole IUPAC Name: 3-(5-butylthiophen-2-yl)-5-(4-octylphenyl)-1,2-oxazole Traditional Name: 3-(5-butyl-2-thienyl)-5-(4-octylphenyl)isoxazole Formula: C25H33NOS MolecularWeight: 395.60062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(S3)CCCC

InChI

InChI=1S/C25H33NOS/c1-3-5-7-8-9-10-11-20-13-15-21(16-14-20)24-19-23(26-27-24)25-18-17-22(28-25)12-6-4-2/h13-19H,3-12H2,1-2H3