4-[4-(3-methylphenyl)-5-(quinolin-8-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[4-(3-methylphenyl)-5-(quinolin-8-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[4-(m-tolyl)-5-(8-quinolylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[4-(3-methylphenyl)-5-(8-quinolinylmethylthio)-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[4-(3-methylphenyl)-5-(quinolin-8-ylmethylsulfanyl)-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[4-(m-tolyl)-5-(8-quinolylmethylthio)-1,2,4-triazol-3-yl]morpholine Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=CC4=C3N=CC=C4)N5CCOCC5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=CC=CC4=C3N=CC=C4)N5CCOCC5

InChI

InChI=1S/C23H23N5OS/c1-17-5-2-9-20(15-17)28-22(27-11-13-29-14-12-27)25-26-23(28)30-16-19-7-3-6-18-8-4-10-24-21(18)19/h2-10,15H,11-14,16H2,1H3