1-(4-phenoxybutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline

Systemtic Name: 1-(4-phenoxybutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline Openeye Name: 1-(4-phenoxybutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline CAS Name: 1-(4-phenoxybutylthio)-[1,2,4]triazolo[4,3-a]quinoline IUPAC Name: 1-(4-phenoxybutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline Traditional Name: 1-(4-phenoxybutylthio)-[1,2,4]triazolo[4,3-a]quinoline Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCCSC2=NN=C3N2C4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)OCCCCSC2=NN=C3N2C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H19N3OS/c1-2-9-17(10-3-1)24-14-6-7-15-25-20-22-21-19-13-12-16-8-4-5-11-18(16)23(19)20/h1-5,8-13H,6-7,14-15H2