3-[(4-chlorophenyl)methylsulfanyl]-5-cyclopentyl-4-ethyl-1,2,4-triazole

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclopentyl-4-ethyl-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclopentyl-4-ethyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-cyclopentyl-4-ethyl-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-cyclopentyl-4-ethyl-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-cyclopentyl-4-ethyl-1,2,4-triazole Formula: C16H20ClN3S MolecularWeight: 321.8681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3CCCC3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3CCCC3

InChI

InChI=1S/C16H20ClN3S/c1-2-20-15(13-5-3-4-6-13)18-19-16(20)21-11-12-7-9-14(17)10-8-12/h7-10,13H,2-6,11H2,1H3