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

Systemtic Name: 3-(3-chlorophenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(3-chlorophenyl)-5-(1-naphthylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-(3-chlorophenyl)-4-(4-methylphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 3-(3-chlorophenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(3-chlorophenyl)-5-(1-naphthylmethylthio)-4-(p-tolyl)-1,2,4-triazole Formula: C26H20ClN3S MolecularWeight: 441.9751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H20ClN3S/c1-18-12-14-23(15-13-18)30-25(20-8-5-10-22(27)16-20)28-29-26(30)31-17-21-9-4-7-19-6-2-3-11-24(19)21/h2-16H,17H2,1H3