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

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 3-[(3-chlorophenyl)methylthio]-4-ethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-ethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzyl)thio]-4-ethyl-5-(2-thenyl)-1,2,4-triazole Formula: C16H16ClN3S2 MolecularWeight: 349.90134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CC3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)Cl)CC3=CC=CS3

InChI

InChI=1S/C16H16ClN3S2/c1-2-20-15(10-14-7-4-8-21-14)18-19-16(20)22-11-12-5-3-6-13(17)9-12/h3-9H,2,10-11H2,1H3