N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O4S/c1-15(18-6-5-7-19(14-18)25-16(2)27)24-22(28)17-10-12-26(13-11-17)31(29,30)21-9-4-3-8-20(21)23/h3-9,14-15,17H,10-13H2,1-2H3,(H,24,28)(H,25,27)