2-(3,5-dimethylphenyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,3,4-oxadiazole

Systemtic Name: 2-(3,5-dimethylphenyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,3,4-oxadiazole Openeye Name: 2-(3,5-dimethylphenyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-(3,5-dimethylphenyl)-5-(6-phenanthridinylmethylthio)-1,3,4-oxadiazole IUPAC Name: 2-(3,5-dimethylphenyl)-5-(phenanthridin-6-ylmethylsulfanyl)-1,3,4-oxadiazole Traditional Name: 2-(3,5-dimethylphenyl)-5-(phenanthridin-6-ylmethylthio)-1,3,4-oxadiazole Formula: C24H19N3OS MolecularWeight: 397.49216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NN=C(O2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53)C

InChI

InChI=1S/C24H19N3OS/c1-15-11-16(2)13-17(12-15)23-26-27-24(28-23)29-14-22-20-9-4-3-7-18(20)19-8-5-6-10-21(19)25-22/h3-13H,14H2,1-2H3