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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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