N-[2-fluoranyl-5-(trifluoromethyl)phenyl]-4-(4-methylphenyl)sulfonyl-piperidine-1-carboxamide

Systemtic Name: N-[2-fluoranyl-5-(trifluoromethyl)phenyl]-4-(4-methylphenyl)sulfonyl-piperidine-1-carboxamide Openeye Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-(p-tolylsulfonyl)piperidine-1-carboxamide CAS Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-(4-methylphenyl)sulfonyl-1-piperidinecarboxamide IUPAC Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-(4-methylphenyl)sulfonylpiperidine-1-carboxamide Traditional Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-tosyl-piperidine-1-carboxamide Formula: C20H20F4N2O3S MolecularWeight: 444.443013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2CCN(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)F

InChI

InChI=1S/C20H20F4N2O3S/c1-13-2-5-15(6-3-13)30(28,29)16-8-10-26(11-9-16)19(27)25-18-12-14(20(22,23)24)4-7-17(18)21/h2-7,12,16H,8-11H2,1H3,(H,25,27)