5-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-propyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-propyl-1,2,4-oxadiazole Openeye Name: 5-[[4-ethyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-propyl-1,2,4-oxadiazole CAS Name: 5-[[[4-ethyl-5-(2-phenyl-4-quinolinyl)-1,2,4-triazol-3-yl]thio]methyl]-3-propyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-ethyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-propyl-1,2,4-oxadiazole Traditional Name: 5-[[[4-ethyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]thio]methyl]-3-propyl-1,2,4-oxadiazole Formula: C25H24N6OS MolecularWeight: 456.56266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=N1)CSC2=NN=C(N2CC)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCCC1=NOC(=N1)CSC2=NN=C(N2CC)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6OS/c1-3-10-22-27-23(32-30-22)16-33-25-29-28-24(31(25)4-2)19-15-21(17-11-6-5-7-12-17)26-20-14-9-8-13-18(19)20/h5-9,11-15H,3-4,10,16H2,1-2H3