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

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-chloranyl-2-methyl-phenyl)piperazine Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-chloro-2-methyl-phenyl)piperazine CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-chloro-2-methylphenyl)piperazine IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-chloro-2-methylphenyl)piperazine Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(3-chloro-2-methyl-phenyl)piperazine Formula: C19H17ClF6N2O2S MolecularWeight: 486.858899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2CCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2CCN(CC2)S(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H17ClF6N2O2S/c1-12-16(20)3-2-4-17(12)27-5-7-28(8-6-27)31(29,30)15-10-13(18(21,22)23)9-14(11-15)19(24,25)26/h2-4,9-11H,5-8H2,1H3