1-[[5-chloranyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]-4-(3-fluorophenyl)sulfonyl-piperazine

Systemtic Name: 1-[[5-chloranyl-2-(pyridin-3-ylmethoxy)phenyl]methyl]-4-(3-fluorophenyl)sulfonyl-piperazine Openeye Name: 1-[[5-chloro-2-(3-pyridylmethoxy)phenyl]methyl]-4-(3-fluorophenyl)sulfonyl-piperazine CAS Name: 1-[[5-chloro-2-(3-pyridinylmethoxy)phenyl]methyl]-4-(3-fluorophenyl)sulfonylpiperazine IUPAC Name: 1-[[5-chloro-2-(pyridin-3-ylmethoxy)phenyl]methyl]-4-(3-fluorophenyl)sulfonylpiperazine Traditional Name: 1-[5-chloro-2-(3-pyridylmethoxy)benzyl]-4-(3-fluorophenyl)sulfonyl-piperazine Formula: C23H23ClFN3O3S MolecularWeight: 475.963423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)Cl)OCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)Cl)OCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C23H23ClFN3O3S/c24-20-6-7-23(31-17-18-3-2-8-26-15-18)19(13-20)16-27-9-11-28(12-10-27)32(29,30)22-5-1-4-21(25)14-22/h1-8,13-15H,9-12,16-17H2