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

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[(2-methoxy-5-methylphenyl)methyl]piperazine IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[(2-methoxy-5-methylphenyl)methyl]piperazine Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-(2-methoxy-5-methyl-benzyl)piperazine Formula: C19H22ClFN2O3S MolecularWeight: 412.905983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H22ClFN2O3S/c1-14-3-6-19(26-2)15(11-14)13-22-7-9-23(10-8-22)27(24,25)16-4-5-18(21)17(20)12-16/h3-6,11-12H,7-10,13H2,1-2H3