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

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-ethyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole CAS Name: 3-[(2-chlorophenyl)methylthio]-5-ethyl-4-(2-oxolanylmethyl)-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-ethyl-4-(oxolan-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(2-chlorobenzyl)thio]-5-ethyl-4-(tetrahydrofurfuryl)-1,2,4-triazole Formula: C16H20ClN3OS MolecularWeight: 337.8675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC2CCCO2)SCC3=CC=CC=C3Cl

Isomeric SMILES

CCC1=NN=C(N1CC2CCCO2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H20ClN3OS/c1-2-15-18-19-16(20(15)10-13-7-5-9-21-13)22-11-12-6-3-4-8-14(12)17/h3-4,6,8,13H,2,5,7,9-11H2,1H3