5-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(o-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[[[4-(o-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-3-phenyl-1,2,4-oxadiazole Formula: C23H18N6OS MolecularWeight: 426.49362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC3=NC(=NO3)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC3=NC(=NO3)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C23H18N6OS/c1-16-7-5-6-10-19(16)29-22(18-11-13-24-14-12-18)26-27-23(29)31-15-20-25-21(28-30-20)17-8-3-2-4-9-17/h2-14H,15H2,1H3