3-[(2-chlorophenyl)methylsulfanyl]-4-methyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-4-methyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(2-chlorophenyl)methylsulfanyl]-4-methyl-5-(1-naphthylmethyl)-1,2,4-triazole CAS Name: 3-[(2-chlorophenyl)methylthio]-4-methyl-5-(1-naphthalenylmethyl)-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-4-methyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(2-chlorobenzyl)thio]-4-methyl-5-(1-naphthylmethyl)-1,2,4-triazole Formula: C21H18ClN3S MolecularWeight: 379.90572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2Cl)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2Cl)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H18ClN3S/c1-25-20(13-16-10-6-9-15-7-2-4-11-18(15)16)23-24-21(25)26-14-17-8-3-5-12-19(17)22/h2-12H,13-14H2,1H3