N-[(4-ethylphenyl)methyl]-1-(4-fluorophenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

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