1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-2-(pyridin-2-ylmethylsulfanyl)ethanone

Systemtic Name: 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-2-(pyridin-2-ylmethylsulfanyl)ethanone Openeye Name: 1-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-2-(2-pyridylmethylsulfanyl)ethanone CAS Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-2-(2-pyridinylmethylthio)ethanone IUPAC Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-2-(pyridin-2-ylmethylsulfanyl)ethanone Traditional Name: 1-[4-(2-chloro-6-fluoro-benzyl)piperazino]-2-(2-pyridylmethylthio)ethanone Formula: C19H21ClFN3OS MolecularWeight: 393.905943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)F)C(=O)CSCC3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)F)C(=O)CSCC3=CC=CC=N3

InChI

InChI=1S/C19H21ClFN3OS/c20-17-5-3-6-18(21)16(17)12-23-8-10-24(11-9-23)19(25)14-26-13-15-4-1-2-7-22-15/h1-7H,8-14H2