5-(4-methoxyphenyl)-3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(4-methoxyphenyl)-3-(1-naphthylmethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-3-(1-naphthalenylmethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-methoxyphenyl)-3-(naphthalen-1-ylmethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(4-methoxyphenyl)-3-(1-naphthylmethylthio)-1H-1,2,4-triazole Formula: C20H17N3OS MolecularWeight: 347.43348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H17N3OS/c1-24-17-11-9-15(10-12-17)19-21-20(23-22-19)25-13-16-7-4-6-14-5-2-3-8-18(14)16/h2-12H,13H2,1H3,(H,21,22,23)