1-(2,4-dimethylphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(4-fluorobenzyl)-N-methyl-isonipecotamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H27FN2O3S/c1-16-4-9-21(17(2)14-16)29(27,28)25-12-10-19(11-13-25)22(26)24(3)15-18-5-7-20(23)8-6-18/h4-9,14,19H,10-13,15H2,1-3H3