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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole Formula: C17H16ClN3OS MolecularWeight: 345.84644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC(=CC=C3)OC

InChI

InChI=1S/C17H16ClN3OS/c1-21-16(13-4-3-5-15(10-13)22-2)19-20-17(21)23-11-12-6-8-14(18)9-7-12/h3-10H,11H2,1-2H3