N-[(3-fluorophenyl)methyl]-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(3-fluorophenyl)methyl]-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(3-fluorophenyl)methyl]-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(3-fluorophenyl)methyl]-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(3-fluorophenyl)methyl]-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-fluorobenzyl)-N-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C24H31FN2O3S MolecularWeight: 446.577943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC(=CC=C3)F)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC(=CC=C3)F)C)C

InChI

InChI=1S/C24H31FN2O3S/c1-16-13-17(2)19(4)23(18(16)3)31(29,30)27-11-9-21(10-12-27)24(28)26(5)15-20-7-6-8-22(25)14-20/h6-8,13-14,21H,9-12,15H2,1-5H3