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

Systemtic Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-(3-methoxyphenyl)-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C26H20ClN3OS MolecularWeight: 457.9745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H20ClN3OS/c1-31-23-10-5-8-19(16-23)25-28-29-26(30(25)22-14-12-21(27)13-15-22)32-17-20-9-4-7-18-6-2-3-11-24(18)20/h2-16H,17H2,1H3