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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(5-methylthiophen-3-yl)-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(5-methyl-3-thienyl)-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-4-ethyl-5-(5-methyl-3-thiophenyl)-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-4-ethyl-5-(5-methylthiophen-3-yl)-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-4-ethyl-5-(5-methyl-3-thienyl)-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=C(C=C2)Cl)C3=CSC(=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CSC(=C3)C

InChI

InChI=1S/C16H16ClN3S2/c1-3-20-15(13-8-11(2)21-10-13)18-19-16(20)22-9-12-4-6-14(17)7-5-12/h4-8,10H,3,9H2,1-2H3