N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

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