1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-(2,5-dimethylphenyl)sulfonylpiperazine IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-(2,5-dimethylphenyl)sulfonylpiperazine Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-4-(2,5-dimethylphenyl)sulfonyl-piperazine Formula: C19H22ClFN2O2S MolecularWeight: 396.906583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

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