1-[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[6-(4-chlorophenyl)-3-pyridazinyl]-1-piperazinyl]-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]ethanone Traditional Name: 2-(benzylthio)-1-[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazino]ethanone Formula: C23H23ClN4OS MolecularWeight: 438.97292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C23H23ClN4OS/c24-20-8-6-19(7-9-20)21-10-11-22(26-25-21)27-12-14-28(15-13-27)23(29)17-30-16-18-4-2-1-3-5-18/h1-11H,12-17H2