1-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazin-1-yl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[4-[[5-(2-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-[4-[[5-(2-chlorophenyl)-2-thienyl]methyl]piperazino]-2-(4-pyridylthio)ethanone Formula: C22H22ClN3OS2 MolecularWeight: 444.01258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3Cl)C(=O)CSC4=CC=NC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3Cl)C(=O)CSC4=CC=NC=C4

InChI

InChI=1S/C22H22ClN3OS2/c23-20-4-2-1-3-19(20)21-6-5-18(29-21)15-25-11-13-26(14-12-25)22(27)16-28-17-7-9-24-10-8-17/h1-10H,11-16H2