4-[4-(4-methylphenyl)-5-(2-methylquinolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[4-(4-methylphenyl)-5-(2-methylquinolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[5-[(2-methyl-4-quinolyl)sulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[4-(4-methylphenyl)-5-[(2-methyl-4-quinolinyl)thio]-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[4-(4-methylphenyl)-5-(2-methylquinolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[5-[(2-methyl-4-quinolyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]morpholine Formula: C23H23N5OS MolecularWeight: 417.52662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC3=CC(=NC4=CC=CC=C43)C)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC3=CC(=NC4=CC=CC=C43)C)N5CCOCC5

InChI

InChI=1S/C23H23N5OS/c1-16-7-9-18(10-8-16)28-22(27-11-13-29-14-12-27)25-26-23(28)30-21-15-17(2)24-20-6-4-3-5-19(20)21/h3-10,15H,11-14H2,1-2H3