9-methoxy-5-methyl-1-(3-phenoxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline

Systemtic Name: 9-methoxy-5-methyl-1-(3-phenoxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline Openeye Name: 9-methoxy-5-methyl-1-(3-phenoxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline CAS Name: 9-methoxy-5-methyl-1-(3-phenoxypropylthio)-[1,2,4]triazolo[4,3-a]quinoline IUPAC Name: 9-methoxy-5-methyl-1-(3-phenoxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline Traditional Name: 9-methoxy-5-methyl-1-(3-phenoxypropylthio)-[1,2,4]triazolo[4,3-a]quinoline Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN=C(N2C3=C1C=CC=C3OC)SCCCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=NN=C(N2C3=C1C=CC=C3OC)SCCCOC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2S/c1-15-14-19-22-23-21(24(19)20-17(15)10-6-11-18(20)25-2)27-13-7-12-26-16-8-4-3-5-9-16/h3-6,8-11,14H,7,12-13H2,1-2H3