1-(3-fluoranyl-4-methyl-phenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine Openeye Name: 1-(3-fluoro-4-methyl-phenyl)sulfonyl-4-[5-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: 1-(3-fluoro-4-methylphenyl)sulfonyl-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine IUPAC Name: 1-(3-fluoro-4-methylphenyl)sulfonyl-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine Traditional Name: 1-(3-fluoro-4-methyl-phenyl)sulfonyl-4-[5-(trifluoromethyl)-2-pyridyl]piperazine Formula: C17H17F4N3O2S MolecularWeight: 403.394393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17F4N3O2S/c1-12-2-4-14(10-15(12)18)27(25,26)24-8-6-23(7-9-24)16-5-3-13(11-22-16)17(19,20)21/h2-5,10-11H,6-9H2,1H3