1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine CAS Name: 1-[(3-chloro-4-fluorophenyl)methyl]-4-(2,5-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(3-chloro-4-fluorophenyl)methyl]-4-(2,5-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(3-chloro-4-fluoro-benzyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine Formula: C19H22ClFN2O2S MolecularWeight: 396.906583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H22ClFN2O2S/c1-14-3-4-15(2)19(11-14)26(24,25)23-9-7-22(8-10-23)13-16-5-6-18(21)17(20)12-16/h3-6,11-12H,7-10,13H2,1-2H3