1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-[(4-pyrazol-1-ylphenyl)methyl]piperazine

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-[(4-pyrazol-1-ylphenyl)methyl]piperazine Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-[(4-pyrazol-1-ylphenyl)methyl]piperazine CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[[4-(1-pyrazolyl)phenyl]methyl]piperazine IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[(4-pyrazol-1-ylphenyl)methyl]piperazine Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-(4-pyrazol-1-ylbenzyl)piperazine Formula: C20H20ClFN4O2S MolecularWeight: 434.914803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H20ClFN4O2S/c21-19-14-18(6-7-20(19)22)29(27,28)25-12-10-24(11-13-25)15-16-2-4-17(5-3-16)26-9-1-8-23-26/h1-9,14H,10-13,15H2