N-(2-fluoranyl-4-methyl-phenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-fluoranyl-4-methyl-phenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-fluoro-4-methyl-phenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-fluoro-4-methylphenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-fluoro-4-methylphenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-fluoro-4-methyl-phenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C23H29FN2O3S MolecularWeight: 432.551363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C)F

InChI

InChI=1S/C23H29FN2O3S/c1-14-6-7-21(20(24)12-14)25-23(27)19-8-10-26(11-9-19)30(28,29)22-17(4)15(2)13-16(3)18(22)5/h6-7,12-13,19H,8-11H2,1-5H3,(H,25,27)