2-(4-tert-butylphenyl)-5-[(4-fluorophenyl)methylamino]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(4-tert-butylphenyl)-5-[(4-fluorophenyl)methylamino]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(4-tert-butylphenyl)-5-[(4-fluorophenyl)methylamino]oxazole-4-carbonitrile CAS Name: 2-(4-tert-butylphenyl)-5-[(4-fluorophenyl)methylamino]-4-oxazolecarbonitrile IUPAC Name: 2-(4-tert-butylphenyl)-5-[(4-fluorophenyl)methylamino]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(4-tert-butylphenyl)-5-[(4-fluorobenzyl)amino]oxazole-4-carbonitrile Formula: C21H20FN3O MolecularWeight: 349.401403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC=C(C=C3)F)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=C(O2)NCC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C21H20FN3O/c1-21(2,3)16-8-6-15(7-9-16)19-25-18(12-23)20(26-19)24-13-14-4-10-17(22)11-5-14/h4-11,24H,13H2,1-3H3