8-[[4-ethyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methoxy]quinoline

Systemtic Name: 8-[[4-ethyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methoxy]quinoline Openeye Name: 8-[(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methoxy]quinoline CAS Name: 8-[[4-ethyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methoxy]quinoline IUPAC Name: 8-[(5-benzylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)methoxy]quinoline Traditional Name: 8-[[5-(benzylthio)-4-ethyl-1,2,4-triazol-3-yl]methoxy]quinoline Formula: C21H20N4OS MolecularWeight: 376.4747

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2)COC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H20N4OS/c1-2-25-19(23-24-21(25)27-15-16-8-4-3-5-9-16)14-26-18-12-6-10-17-11-7-13-22-20(17)18/h3-13H,2,14-15H2,1H3