4-[3-[4-(pyridin-2-ylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-quinolin-3-yl-butanoic acid

Systemtic Name: 4-[3-[4-(pyridin-2-ylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-quinolin-3-yl-butanoic acid Openeye Name: 4-[3-[4-(2-pyridylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-(3-quinolyl)butanoic acid CAS Name: 4-[3-[4-(2-pyridinylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-(3-quinolinyl)butanoic acid IUPAC Name: 4-[3-[4-(pyridin-2-ylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-quinolin-3-ylbutanoic acid Traditional Name: 4-[3-[4-(2-pyridylamino)butyl]-1,2,4-oxadiazol-5-yl]-3-(3-quinolyl)butyric acid Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(CC3=NC(=NO3)CCCCNC4=CC=CC=N4)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(CC3=NC(=NO3)CCCCNC4=CC=CC=N4)CC(=O)O

InChI

InChI=1S/C24H25N5O3/c30-24(31)15-18(19-13-17-7-1-2-8-20(17)27-16-19)14-23-28-22(29-32-23)10-4-6-12-26-21-9-3-5-11-25-21/h1-3,5,7-9,11,13,16,18H,4,6,10,12,14-15H2,(H,25,26)(H,30,31)