5-(4-butylphenyl)-3-(5-heptylthiophen-2-yl)-1,2-oxazole

Systemtic Name: 5-(4-butylphenyl)-3-(5-heptylthiophen-2-yl)-1,2-oxazole Openeye Name: 5-(4-butylphenyl)-3-(5-heptyl-2-thienyl)isoxazole CAS Name: 5-(4-butylphenyl)-3-(5-heptyl-2-thiophenyl)isoxazole IUPAC Name: 5-(4-butylphenyl)-3-(5-heptylthiophen-2-yl)-1,2-oxazole Traditional Name: 5-(4-butylphenyl)-3-(5-heptyl-2-thienyl)isoxazole Formula: C24H31NOS MolecularWeight: 381.57404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(S1)C2=NOC(=C2)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCCC1=CC=C(S1)C2=NOC(=C2)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C24H31NOS/c1-3-5-7-8-9-11-21-16-17-24(27-21)22-18-23(26-25-22)20-14-12-19(13-15-20)10-6-4-2/h12-18H,3-11H2,1-2H3