2-ethyl-3-phenyl-4-[4-[5-(pyridin-2-ylamino)pentyl]-1,3-oxazol-2-yl]butanoic acid

Systemtic Name: 2-ethyl-3-phenyl-4-[4-[5-(pyridin-2-ylamino)pentyl]-1,3-oxazol-2-yl]butanoic acid Openeye Name: 2-ethyl-3-phenyl-4-[4-[5-(2-pyridylamino)pentyl]oxazol-2-yl]butanoic acid CAS Name: 2-ethyl-3-phenyl-4-[4-[5-(2-pyridinylamino)pentyl]-2-oxazolyl]butanoic acid IUPAC Name: 2-ethyl-3-phenyl-4-[4-[5-(pyridin-2-ylamino)pentyl]-1,3-oxazol-2-yl]butanoic acid Traditional Name: 2-ethyl-3-phenyl-4-[4-[5-(2-pyridylamino)pentyl]oxazol-2-yl]butyric acid Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1=NC(=CO1)CCCCCNC2=CC=CC=N2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC(C(CC1=NC(=CO1)CCCCCNC2=CC=CC=N2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H31N3O3/c1-2-21(25(29)30)22(19-11-5-3-6-12-19)17-24-28-20(18-31-24)13-7-4-9-15-26-23-14-8-10-16-27-23/h3,5-6,8,10-12,14,16,18,21-22H,2,4,7,9,13,15,17H2,1H3,(H,26,27)(H,29,30)