5-[2-(4-bromanylphenoxy)ethylsulfanyl]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[2-(4-bromanylphenoxy)ethylsulfanyl]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-[2-(4-bromophenoxy)ethylsulfanyl]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-[2-(4-bromophenoxy)ethylthio]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-[2-(4-bromophenoxy)ethylsulfanyl]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-[2-(4-bromophenoxy)ethylthio]-3-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Formula: C16H12BrClN2OS3 MolecularWeight: 459.83128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=S)SC(=N2)SCCOC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=S)SC(=N2)SCCOC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C16H12BrClN2OS3/c17-11-1-7-14(8-2-11)21-9-10-23-15-19-20(16(22)24-15)13-5-3-12(18)4-6-13/h1-8H,9-10H2